untitled.cdx
csChFnd80/06042113042D

 26 28  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (1)
19

>  <Formula> (1)
C21H23N3O2

>  <MolWeight> (1)
349.42622

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S1030

>  <Name> (1)
Panobinostat (LBH589)

>  <Synonyms> (1)
N/A 

>  <Target> (1)
HDAC 

>  <Form> (1)
Free Base

>  <CAS> (1)
404950-80-7

>  <URL> (1)
http://www.selleckchem.com/products/LBH-589.html

$$$$
AR-42.cdx
csChFnd80/06042113042D

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M  END
>  <Mol_ID> (2)
25

>  <Formula> (2)
C18H20N2O3

>  <MolWeight> (2)
312.363

>  <Cat> (2)
S2244

>  <Name> (2)
AR-42 (HDAC-42)

>  <Synonyms> (2)
OSU-HDAC42

>  <Target> (2)
HDAC 

>  <Form> (2)
Free Base

>  <CAS> (2)
935881-37-1

>  <URL> (2)
http://www.selleckchem.com/products/AR-42-HDAC-42.html

$$$$
vorinostat.cdx
csChFnd80/06042113042D

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M  END
>  <Mol_ID> (3)
31

>  <Formula> (3)
C14H20N2O3

>  <MolWeight> (3)
264.3202

>  <Cat> (3)
S1047

>  <Name> (3)
Vorinostat (SAHA, MK0683)

>  <Synonyms> (3)
SAHA, MK0683, suberoylanilide hydroxamic acid

>  <Target> (3)
HDAC

>  <Form> (3)
Free Base

>  <CAS> (3)
149647-78-9

>  <URL> (3)
http://www.selleckchem.com/products/Vorinostat-(SAHA).html

$$$$
untitled.cdx
csChFnd80/06042113042D

 28 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (4)
35

>  <Formula> (4)
C21H20N4O3

>  <MolWeight> (4)
376.4085

>  <Cat> (4)
S1053

>  <Name> (4)
Entinostat (MS-275, SNDX-275)

>  <Synonyms> (4)
SNDX-275

>  <Target> (4)
HDAC 

>  <Form> (4)
Free Base

>  <CAS> (4)
209783-80-2

>  <URL> (4)
http://www.selleckchem.com/products/MS-275.html

$$$$
untitled.cdx
csChFnd80/06042113042D

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M  END
>  <Mol_ID> (5)
52

>  <Formula> (5)
C15H14N2O4S

>  <MolWeight> (5)
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>  <Cat> (5)
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>  <Name> (5)
Belinostat (PXD101)

>  <Synonyms> (5)
N/A 

>  <Target> (5)
HDAC 

>  <Form> (5)
Free Base

>  <CAS> (5)
414864-00-9

>  <URL> (5)
http://www.selleckchem.com/products/Belinostat.html

$$$$
untitled.cdx
csChFnd80/06042113042D

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77

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C25H24ClN7OS

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>  <Name> (10)
SRT1720 HCl

>  <Synonyms> (10)
N/A

>  <Target> (10)
Sirtuin

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Hydrochloride

>  <CAS> (10)
1001645-58-4

>  <URL> (10)
http://www.selleckchem.com/products/SRT1720.html

$$$$
S119401 CUDC-101.cdx
csChFnd80/06042113042D

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120

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C24H26N4O4

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N/A

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HDAC, EGFR, HER2

>  <Form> (11)
Free Base

>  <CAS> (11)
1012054-59-9

>  <URL> (11)
http://www.selleckchem.com/products/CUDC-101.html

$$$$
Nicotinamide.cdx
csChFnd80/06042113042D

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>  <Mol_ID> (12)
188

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C6H6N2O

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Nicotinamide (Vitamin B3)

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>  <Target> (12)
Sirtuin

>  <Form> (12)
Free Base

>  <CAS> (12)
98-92-0

>  <URL> (12)
http://www.selleckchem.com/products/Nicotinamide(Niacinamide).html

$$$$
resveratrol.cdx
csChFnd80/06042113042D

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>  <Mol_ID> (13)
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Sirtuin

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Free Base

>  <CAS> (13)
501-36-0

>  <URL> (13)
http://www.selleckchem.com/products/Resveratrol.html

$$$$
Droxinostat.cdx
csChFnd80/06042113042D

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Droxinostat

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N/A

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HDAC 

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Free Base

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99873-43-5

>  <URL> (14)
http://www.selleckchem.com/products/Droxinostat.html

$$$$
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MC1568

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HDAC 

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Free Base

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852475-26-4

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http://www.selleckchem.com/products/MC1568.html

$$$$
SB 939.cdx
csChFnd80/06042113042D

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316

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C20H30N4O2

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S1515

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SB939 (Pracinostat)

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N/A 

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HDAC

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Free Base

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929016-96-6

>  <URL> (16)
http://www.selleckchem.com/products/SB939.html

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EX527.cdx
csChFnd80/06042113042D

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>  <Mol_ID> (17)
340

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C13H13ClN2O

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SEN0014196

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Sirtuin

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Free Base

>  <CAS> (17)
49843-98-3

>  <URL> (17)
http://www.selleckchem.com/products/EX-527.html

$$$$
DIVALPROEX (divalproex sodium).cdx
csChFnd80/06042113042D

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>  <Mol_ID> (18)
422

>  <Formula> (18)
C16H31NaO4

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310.40471

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S1703

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Divalproex sodium

>  <Synonyms> (18)
Depakote, Epival

>  <Target> (18)
HDAC

>  <Form> (18)
Sodium Salt

>  <CAS> (18)
76584-70-8

>  <URL> (18)
http://www.selleckchem.com/products/Divalproex-sodium.html

$$$$
PCI-34051.cdx
csChFnd80/06042113042D

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>  <Mol_ID> (19)
568

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C17H16N2O3

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PCI-34051

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HDAC 

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Free Base

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950762-95-5

>  <URL> (19)
http://www.selleckchem.com/products/pci-34051.html

$$$$
CUDC-907.cdx
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1339928-25-4

>  <URL> (20)
http://www.selleckchem.com/products/cudc-907.html

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M344.cdx
csChFnd80/06042113042D

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HDAC

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Free Base

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251456-60-7 

>  <URL> (21)
http://www.selleckchem.com/products/m344.html

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Bufexamac.cdx
csChFnd80/06042113042D

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HDAC 

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Free Base

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2438-72-4

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http://www.selleckchem.com/products/bufexamac.html

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Sirtinol.cdx
csChFnd80/06042113042D

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C26H22N2O2

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Sirtinol

>  <Synonyms> (23)
N/A 

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Sirtuin 

>  <Form> (23)
Free Base

>  <CAS> (23)
410536-97-9

>  <URL> (23)
http://www.selleckchem.com/products/sirtinol.html

$$$$
CI994.cdx
csChFnd80/06042113042D

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CI994 (Tacedinaline)

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PD-123654 

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HDAC

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Free Base

>  <CAS> (24)
112522-64-2

>  <URL> (24)
http://www.selleckchem.com/products/ci994-tacedinaline.html

$$$$
Quercetin.cdx
csChFnd80/06042113042D

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Quercetin (Sophoretin)

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Meletin, Quercetine

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PI3K, PKC, Src, Sirtuin

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>  <CAS> (25)
117-39-5

>  <URL> (25)
http://www.selleckchem.com/products/Quercetin(Sophoretin).html

$$$$

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   11.2785   -2.7999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4330   -2.8023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2206   -3.5023    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.0123   -2.8048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7999   -3.5048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2206   -4.8975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0081   -5.5976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6992   -5.5976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9074   -4.8999    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.1156   -5.5976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3239   -4.8999    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   18.5321   -5.5976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1156   -6.9926    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.5321   -6.9975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7445   -7.6975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.9570   -6.9975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.9570   -5.5976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7445   -4.8975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.1652   -7.6950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.3734   -6.9975    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   24.5817   -7.6950    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.1652   -9.0902    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3552   -9.5521    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9433   -9.7124    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  3  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  4  1  0  0  0  0
  6 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 12 15  1  0  0  0  0
 15 16  1  0  0  0  0
  8 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 19 22  2  0  0  0  0
 21 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 27 21  1  0  0  0  0
 25 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 28 31  2  0  0  0  0
M  END
>  <Mol_ID> (26)
658

>  <Formula> (26)
C24H30ClN3O5

>  <MolWeight> (26)
475.9651

>  <Cat> (26)
S2170

>  <Name> (26)
ITF2357 (Givinostat)

>  <Synonyms> (26)
N/A 

>  <Target> (26)
HDAC 

>  <Form> (26)
Chloride

>  <CAS> (26)
732302-99-7

>  <URL> (26)
http://www.selleckchem.com/products/ITF2357(Givinostat).html

$$$$
Fisetin.cdx
csChFnd80/06042113042D

 21 23  0  0  0  0  0  0  0  0999 V2000
    3.6331    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0580    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0580    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    4.1951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.1927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    1.3976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4786    3.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6911    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6911    5.5927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4786    6.2927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    5.5927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8993    6.2903    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8993    3.4951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10  2  1  0  0  0  0
  4 11  1  0  0  0  0
  7 12  2  0  0  0  0
  8 13  1  0  0  0  0
  9 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 14  1  0  0  0  0
 17 20  1  0  0  0  0
 16 21  1  0  0  0  0
M  END
>  <Mol_ID> (27)
723

>  <Formula> (27)
C15H10O6

>  <MolWeight> (27)
286.2363

>  <Cat> (27)
S2298

>  <Name> (27)
Fisetin (Fustel)

>  <Synonyms> (27)
Fustel, Viset

>  <Target> (27)
Sirtuin

>  <Form> (27)
Free Base

>  <CAS> (27)
528-48-3

>  <URL> (27)
http://www.selleckchem.com/products/Fisetin(Fustel).html

$$$$
Parthenolide.cdx
csChFnd80/06042113042D

 18 20  0  0  0  0  0  0  0  0999 V2000
    0.0000    4.8240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.4240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.7240    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.4249    3.4240    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.4249    4.8240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    5.5240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.7240    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.8497    3.4240    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.8497    4.8240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    5.5240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9284    1.3546    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3207    1.2082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8901    2.4872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    6.2240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2548    2.7773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0183    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.0240    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5149    1.5157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  7 11  1  6  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
  8 13  1  1  0  0  0
  5 14  1  0  0  0  0
 13 15  2  0  0  0  0
 12 16  2  0  0  0  0
  3 17  1  0  0  0  0
  4 17  1  1  0  0  0
  3 18  1  1  0  0  0
M  END
>  <Mol_ID> (28)
757

>  <Formula> (28)
C15H20O3

>  <MolWeight> (28)
248.3175

>  <Cat> (28)
S2341

>  <Name> (28)
Parthenolide ((-)-Parthenolide)

>  <Synonyms> (28)
N/A 

>  <Target> (28)
HDAC,NF-¦ÊB,Mdm2,p53

>  <Form> (28)
Free Base

>  <CAS> (28)
20554-84-1

>  <URL> (28)
http://www.selleckchem.com/products/Parthenolide((-)-Parthenolide).html

$$$$
Quercetin dihydrate.cdx
csChFnd80/06042113042D

 24 24  0  0  0  0  0  0  0  0999 V2000
    1.2082    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0580    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0580    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    4.1951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.1927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    1.3976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4786    3.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6911    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6911    5.5927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4786    6.2927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    5.5927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4786    7.6879    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8993    6.2903    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1496    3.8440    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7497    3.8440    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  1 11  1  0  0  0  0
  3 12  1  0  0  0  0
  7 13  2  0  0  0  0
  8 14  1  0  0  0  0
  9 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 15  1  0  0  0  0
 19 21  1  0  0  0  0
 18 22  1  0  0  0  0
M  END
>  <Mol_ID> (29)
762

>  <Formula> (29)
C15H14O9

>  <MolWeight> (29)
338.26626

>  <Cat> (29)
S2347

>  <Name> (29)
Quercetin dihydrate (Sophoretin)

>  <Synonyms> (29)
Sophoretin, Meletin, Quercetine, Xanthaurine, Quercetol, Quercitin 

>  <Target> (29)
Others

>  <Form> (29)
Dihydrate

>  <CAS> (29)
6151-25-3

>  <URL> (29)
http://www.selleckchem.com/products/Quercetin-dihydrate(Sophoretin).html

$$$$
Curcumin.cdx
csChFnd80/06042113042D

 27 28  0  0  0  0  0  0  0  0999 V2000
    2.4249    2.1073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6415    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8582    0.7024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8582    2.1073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6415    2.8098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8073    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.0024    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0706    2.8073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2831    2.1073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4955    2.8073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7079    2.1073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9204    2.8073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1328    2.1073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3452    2.8073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5577    2.1073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4955    4.2073    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9204    4.2073    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5577    0.7024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7743    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9910    0.7024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9910    2.1073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7743    2.8098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2034    0.0024    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.2034    2.8073    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.4158    2.1073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  2  9  1  0  0  0  0
  5 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 12 18  2  0  0  0  0
 14 19  1  0  0  0  0
 17 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 17  1  0  0  0  0
 22 25  1  0  0  0  0
 23 26  1  0  0  0  0
 26 27  1  0  0  0  0
M  END
>  <Mol_ID> (30)
907

>  <Formula> (30)
C21H20O6

>  <MolWeight> (30)
368.3799

>  <Cat> (30)
S1848

>  <Name> (30)
Curcumin

>  <Synonyms> (30)
Diferuloylmethane, Natural Yellow 3, C.I. 75300 

>  <Target> (30)
NF-¦ÊB,Histone Acetyltransferase,Nrf2

>  <Form> (30)
Free Base

>  <CAS> (30)
458-37-7

>  <URL> (30)
http://www.selleckchem.com/products/Curcumin.html

$$$$
ICG001.cdx
csChFnd80/06042113042D

 42 47  0  0  0  0  0  0  0  0999 V2000
    0.0000   10.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    9.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    8.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    9.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249   10.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
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 31 26  1  0  0  0  0
 29 32  1  0  0  0  0
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 41 42  2  0  0  0  0
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M  END
>  <Mol_ID> (31)
914

>  <Formula> (31)
C33H32N4O4

>  <MolWeight> (31)
548.63158

>  <Cat> (31)
S2662

>  <Name> (31)
ICG-001

>  <Synonyms> (31)
N/A

>  <Target> (31)
Wnt/beta-catenin

>  <Form> (31)
Free Base

>  <CAS> (31)
780757-88-2

>  <URL> (31)
http://www.selleckchem.com/products/icg-001.html

$$$$
Tubastatin A hydrochloride.cdx
csChFnd80/06042113042D

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  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
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M  END
>  <Mol_ID> (32)
958

>  <Formula> (32)
C20H22ClN3O2

>  <MolWeight> (32)
371.86058

>  <Cat> (32)
S2627

>  <Name> (32)
Tubastatin A hydrochloride

>  <Synonyms> (32)
N/A

>  <Target> (32)
HDAC

>  <Form> (32)
Hydrochloride

>  <CAS> (32)
1310693-92-5

>  <URL> (32)
http://www.selleckchem.com/products/tubastatin-a-hcl.html

$$$$
Entacapone.cdx
csChFnd80/06042113042D

 22 22  0  0  0  0  0  0  0  0999 V2000
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 10 11  1  0  0  0  0
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M  END
>  <Mol_ID> (33)
1041

>  <Formula> (33)
C14H15N3O5

>  <MolWeight> (33)
305.286

>  <Cat> (33)
S3147

>  <Name> (33)
Entacapone

>  <Synonyms> (33)
N/A 

>  <Target> (33)
Histone Methyltransferase

>  <Form> (33)
Free Base

>  <CAS> (33)
130929-57-6

>  <URL> (33)
http://www.selleckchem.com/products/entacapone.html

$$$$
PF-06405761.cdx
csChFnd80/06042113042D

 24 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (34)
1264

>  <Formula> (34)
C16H17N3O4S

>  <MolWeight> (34)
347.38888

>  <Cat> (34)
S1216

>  <Name> (34)
PFI-1(PF-6405761) 

>  <Synonyms> (34)
PF-06405761

>  <Target> (34)
Epigenetic Reader Domain

>  <Form> (34)
Free Base

>  <CAS> (34)
1403764-72-6

>  <URL> (34)
http://www.selleckchem.com/products/pfl-1.html

$$$$
Tolcapone.cdx
csChFnd80/06042113042D

 20 21  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (35)
1278

>  <Formula> (35)
C14H11NO5

>  <MolWeight> (35)
273.24084

>  <Cat> (35)
S4021

>  <Name> (35)
Tolcapone

>  <Synonyms> (35)
N/A

>  <Target> (35)
Transferase

>  <Form> (35)
Free Base

>  <CAS> (35)
134308-13-7

>  <URL> (35)
http://www.selleckchem.com/products/tolcapone.html

$$$$
sodium phenylbutyrate.cdx
csChFnd80/06042113042D

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M  END
>  <Mol_ID> (36)
1333

>  <Formula> (36)
C10H11NaO2

>  <MolWeight> (36)
186.18291

>  <Cat> (36)
S4125

>  <Name> (36)
Sodium Phenylbutyrate

>  <Synonyms> (36)
N/A

>  <Target> (36)
HDAC

>  <Form> (36)
Sodium Salt

>  <CAS> (36)
1716-12-7

>  <URL> (36)
https://www.selleckchem.com/products/sodium-phenylbutyrate.html

$$$$
4SC-201(resminostat,BYK408740).cdx
csChFnd80/06042113042D

 24 25  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (37)
1379

>  <Formula> (37)
C16H19N3O4S

>  <MolWeight> (37)
349.40476

>  <Cat> (37)
S2693

>  <Name> (37)
Resminostat (RAS2410)

>  <Synonyms> (37)
4SC-201, BYK408740

>  <Target> (37)
HDAC

>  <Form> (37)
Free Base

>  <CAS> (37)
864814-88-0

>  <URL> (37)
http://www.selleckchem.com/products/resminostat-ras2410.html

$$$$
Tenovin-6 HCl.cdx
csChFnd80/06042113042D

 33 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (38)
1499

>  <Formula> (38)
C25H35ClN4O2S

>  <MolWeight> (38)
491.089

>  <Cat> (38)
S4900

>  <Name> (38)
Tenovin-6

>  <Synonyms> (38)
N/A

>  <Target> (38)
p53,Sirtuin

>  <Form> (38)
Free Base

>  <CAS> (38)
1011557-82-6

>  <URL> (38)
http://www.selleckchem.com/products/tenovin-6.html

$$$$
S1096-JNJ26481585.cdx
csChFnd80/06042113042D

 31 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (39)
1558

>  <Formula> (39)
C21H28Cl2N6O2

>  <MolWeight> (39)
467.39202

>  <Cat> (39)
S1096

>  <Name> (39)
Quisinostat (JNJ-26481585) 2HCl

>  <Synonyms> (39)
N/A

>  <Target> (39)
HDAC

>  <Form> (39)
Dihydrochloride

>  <CAS> (39)
875320-31-3

>  <URL> (39)
http://www.selleckchem.com/products/JNJ-26481585.html

$$$$

csChFnd80/06042113042D

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   19.1676    0.6899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.7708    9.5412    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    8.3708    9.5412    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    9.7222   22.7732    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   22.7732    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  6 11  2  0  0  0  0
  7 12  2  0  0  0  0
  8 11  1  0  0  0  0
  9 12  1  0  0  0  0
 10 13  1  0  0  0  0
 10 14  2  0  0  0  0
 12 15  1  0  0  0  0
 13 16  2  0  0  0  0
 14 17  1  0  0  0  0
 16 18  1  0  0  0  0
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 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
 20 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
M  END
>  <Mol_ID> (40)
1630

>  <Formula> (40)
C20H28Cl3N3O3

>  <MolWeight> (40)
464.81362

>  <Cat> (40)
S4589

>  <Name> (40)
Amodiaquin (dihydrochloride dihydrate)

>  <Synonyms> (40)
N/A

>  <Target> (40)
Transferase,Histone

>  <Form> (40)
dihydrochloride dihydrate

>  <CAS> (40)
6398-98-7

>  <URL> (40)
http://www.selleckchem.com/products/amodiaquin-dihydrochloride-dihydrate.html

$$$$
S4735 Salvianolic acid B.cdx
csChFnd80/06042113042D

 52 56  0  0  0  0  0  0  0  0999 V2000
   10.9455    3.5183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2911    3.9469    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.9455    2.1066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7221    4.2247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1128    2.8021    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   12.7306    5.2762    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2825    1.6712    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7216    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5039    3.5213    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7221    5.6247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5127    2.8021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1015    5.5601    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7406    6.2661    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4990    2.1058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7216    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5096    6.3247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2033    1.5915    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2082    4.0038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5410    6.8893    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.5096    7.7247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5927    1.5930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6010    4.0038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9119    7.1733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5510    7.8793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2972    8.4247    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7221    8.4247    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.2894    2.7921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2927    0.3805    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.3514    8.5025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9134    9.2316    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1988    7.5169    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0848    7.7247    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   18.6894    2.7921    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.7092    8.7261    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3860    9.5002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8723    8.4247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0848    6.3247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1883   10.0380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8594   10.8716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6599    7.7247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8723    5.6247    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2972    5.6247    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.2586   11.1376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.5667   10.2829    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6599    6.3124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4399    8.4290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7261   12.4573    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4346    5.6049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2178    7.7234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    6.3112    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4346    4.2049    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    5.6112    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
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  2  5  1  0  0  0  0
  2  6  1  6  0  0  0
  3  7  1  0  0  0  0
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  4  9  2  0  0  0  0
  4 10  1  0  0  0  0
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 12 19  1  0  0  0  0
 16 20  1  0  0  0  0
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 19 24  1  1  0  0  0
 20 25  1  0  0  0  0
 20 26  2  0  0  0  0
 21 27  1  0  0  0  0
 21 28  1  0  0  0  0
 22 27  2  0  0  0  0
 23 29  1  0  0  0  0
 24 30  1  0  0  0  0
 24 31  2  0  0  0  0
 32 25  1  0  0  0  0
 27 33  1  0  0  0  0
 29 34  1  0  0  0  0
 29 35  2  0  0  0  0
 32 36  1  0  0  0  0
 32 37  1  1  0  0  0
 34 38  2  0  0  0  0
 35 39  1  0  0  0  0
 36 40  1  0  0  0  0
 37 41  1  0  0  0  0
 37 42  2  0  0  0  0
 38 43  1  0  0  0  0
 38 44  1  0  0  0  0
 39 43  2  0  0  0  0
 40 45  2  0  0  0  0
 40 46  1  0  0  0  0
 43 47  1  0  0  0  0
 45 48  1  0  0  0  0
 46 49  2  0  0  0  0
 48 50  2  0  0  0  0
 48 51  1  0  0  0  0
 49 50  1  0  0  0  0
 50 52  1  0  0  0  0
M  END
>  <Mol_ID> (41)
1720

>  <Formula> (41)
C36H30O16

>  <MolWeight> (41)
718.6138

>  <Cat> (41)
S4735

>  <Name> (41)
Salvianolic acid B

>  <Synonyms> (41)
Lithospermate B

>  <Target> (41)
Others

>  <Form> (41)
Free Base

>  <CAS> (41)
121521-90-2

>  <URL> (41)
http://www.selleckchem.com/products/salvianolic-acid-b.html

$$$$
S3981 Sinapinic Acid.cdx
csChFnd80/06042113042D

 16 16  0  0  0  0  0  0  0  0999 V2000
    1.2131    4.1786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.7987    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4275    4.8822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0007    4.8786    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4153    2.0993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.0987    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6446    4.1776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0007    6.2781    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6392    2.8004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4153    0.6993    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8571    4.8776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6264    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0706    4.1769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2643    4.8661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4487    4.1823    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2643    6.2982    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  4  8  1  0  0  0  0
  5  9  2  0  0  0  0
  5 10  1  0  0  0  0
  7 11  1  0  0  0  0
  7  9  1  0  0  0  0
 10 12  1  0  0  0  0
 11 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
M  END
>  <Mol_ID> (42)
1880

>  <Formula> (42)
C11H12O5

>  <MolWeight> (42)
224.20998

>  <Cat> (42)
S3981

>  <Name> (42)
Sinapinic Acid

>  <Synonyms> (42)
Sinapic acid

>  <Target> (42)
Others

>  <Form> (42)
free base

>  <CAS> (42)
530-59-6

>  <URL> (42)
http://www.selleckchem.com/products/sinapinic-acid.html

$$$$
S3984 Nordihydroguaiaretic acid.cdx
csChFnd80/06042113042D

 22 23  0  0  0  0  0  0  0  0999 V2000
    8.5458    2.8429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3334    2.1429    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.1209    2.8429    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.9085    2.1429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1209    4.2429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3334    0.7429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6961    2.8429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3627    2.0803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.7935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2298    4.2027    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5137    4.8860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6909    4.1191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0173    4.9027    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.0935    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7582    2.1429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9749    2.8453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2155    2.0977    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1617    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9804    0.0488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7583    0.7460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3742    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.4280    2.7977    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  2  6  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
  7 12  2  0  0  0  0
 10 13  1  0  0  0  0
  9 14  1  0  0  0  0
  4  7  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 15 20  2  0  0  0  0
 18 21  1  0  0  0  0
 17 22  1  0  0  0  0
  1 15  1  0  0  0  0
M  END
>  <Mol_ID> (43)
1882

>  <Formula> (43)
C18H22O4

>  <MolWeight> (43)
302.36488

>  <Cat> (43)
S3984

>  <Name> (43)
Nordihydroguaiaretic acid

>  <Synonyms> (43)
N/A

>  <Target> (43)
lipoxygenase

>  <Form> (43)
free base

>  <CAS> (43)
500-38-9

>  <URL> (43)
http://www.selleckchem.com/products/nordihydroguaiaretic-acid.html

$$$$
S3781 Ginkgolide C.cdx
csChFnd80/06042113042D

 32 37  0  0  0  0  0  0  0  0999 V2000
    6.0576    3.5342    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.2155    4.9289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2155    3.5288    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4168    5.6360    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.6325    4.9289    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.6263    3.5288    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.8359    2.8234    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.0574    4.9185    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.2654    5.6136    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4683    4.8968    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.4490    3.5006    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   10.8595    3.4670    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.8789    4.8632    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2162    1.4191    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
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   10.6277    0.4100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0379    1.4001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  8  1  1  0  0  0  0
 11  1  1  0  0  0  0
  1  7  1  6  0  0  0
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  4 20  1  1  0  0  0
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  5  8  1  0  0  0  0
  5 21  1  1  0  0  0
  5  6  1  0  0  0  0
  6 22  1  1  0  0  0
  6  7  1  0  0  0  0
  7 25  1  1  0  0  0
  8 18  1  1  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 10 11  1  0  0  0  0
 14 10  1  0  0  0  0
 11 16  1  0  0  0  0
 11 12  1  0  0  0  0
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 13 24  2  0  0  0  0
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 15 17  1  0  0  0  0
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 18 28  2  0  0  0  0
 27 30  1  0  0  0  0
 27 31  1  0  0  0  0
 27 32  1  0  0  0  0
M  END
>  <Mol_ID> (44)
1981

>  <Formula> (44)
C20H24O11

>  <MolWeight> (44)
440.39796

>  <Cat> (44)
S3781

>  <Name> (44)
Ginkgolide C

>  <Synonyms> (44)
BN-52022

>  <Target> (44)
Others

>  <Form> (44)
free base

>  <CAS> (44)
15291-76-6

>  <URL> (44)
http://www.selleckchem.com/products/ginkgolide-c.html

$$$$
Scriptaid (GCK 1026).cdx
csChFnd80/06042113042D

 24 26  0  0  0  0  0  0  0  0999 V2000
    2.4165    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6289    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6289    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0538    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6289    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    4.8976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
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 10  5  1  0  0  0  0
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 13  6  1  0  0  0  0
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 11 15  2  0  0  0  0
 12 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 21 23  2  0  0  0  0
 22 24  1  0  0  0  0
M  END
>  <Mol_ID> (45)
2017

>  <Formula> (45)
C18H18N2O4

>  <MolWeight> (45)
326.34652

>  <Cat> (45)
S8043

>  <Name> (45)
Scriptaid 

>  <Synonyms> (45)
Scriptide, GCK 1026

>  <Target> (45)
HDAC

>  <Form> (45)
Free Base

>  <CAS> (45)
287383-59-9

>  <URL> (45)
https://www.selleckchem.com/products/scriptaid.html

$$$$
EPZ004777.cdx
csChFnd80/06042113042D

 39 42  0  0  0  0  0  0  0  0999 V2000
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    4.5032    3.6224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2196    4.1813    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.2667    5.5479    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   16.6017    5.1262    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   17.4153    6.2656    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   16.5831    7.3914    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   15.2552    6.9478    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   18.8152    6.2771    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.0453    3.7983    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.3326    9.1700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3211   10.5699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9861   10.9915    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1725    9.8522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.5507    8.4800    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   20.7574    9.1899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.7459   10.5899    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 27 23  1  0  0  0  0
 26 28  1  1  0  0  0
 25 29  1  6  0  0  0
 24 30  1  6  0  0  0
 23 19  1  1  0  0  0
 28 31  1  0  0  0  0
 31 32  2  0  0  0  0
 32 33  1  0  0  0  0
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 36 37  1  0  0  0  0
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 38 32  1  0  0  0  0
 38 39  1  0  0  0  0
M  END
>  <Mol_ID> (46)
2025

>  <Formula> (46)
C28H41N7O4

>  <MolWeight> (46)
539.66964

>  <Cat> (46)
S7353

>  <Name> (46)
EPZ004777

>  <Synonyms> (46)
N/A

>  <Target> (46)
Histone Methyltransferase

>  <Form> (46)
Free Base

>  <CAS> (46)
1338466-77-5

>  <URL> (46)
https://www.selleckchem.com/products/epz004777.html

$$$$
S4800 Daminozide.cdx
csChFnd80/06042113042D

 11 10  0  0  0  0  0  0  0  0999 V2000
    4.8497    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2124    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
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  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
  7 11  2  0  0  0  0
M  END
>  <Mol_ID> (47)
2098

>  <Formula> (47)
C6H12N2O3

>  <MolWeight> (47)
160.17108

>  <Cat> (47)
S4800

>  <Name> (47)
Daminozide

>  <Synonyms> (47)
Aminozide, Succinic Acid

>  <Target> (47)
PHF8,KDM2A 

>  <Form> (47)
free base

>  <CAS> (47)
1596-84-5

>  <URL> (47)
http://www.selleckchem.com/products/daminozide.html

$$$$
Sodium valproate.cdx
csChFnd80/06042113042D

 11 10  0  0  0  0  0  0  0  0999 V2000
    0.0000    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    4.2000    0.0000 Na  0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5  8  2  0  0  0  0
  4  9  1  0  0  0  0
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 10 11  1  0  0  0  0
  6  7  1  0  0  0  0
M  END
>  <Mol_ID> (48)
2267

>  <Formula> (48)
C8H15NaO2

>  <MolWeight> (48)
166.19327

>  <Cat> (48)
S1168

>  <Name> (48)
Valproic acid sodium salt (Sodium valproate)

>  <Synonyms> (48)
N/A 

>  <Target> (48)
GABA Receptor, HDAC

>  <CAS> (48)
1069-66-5, 99-66-1 (FREE BASE)

>  <URL> (48)
http://www.selleckchem.com/products/Sodium-valproate.html

$$$$
ACY-1215.cdx
csChFnd80/06042113042D

 32 34  0  0  0  0  0  0  0  0999 V2000
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    3.6331    5.5854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8413    3.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (49)
2321

>  <Formula> (49)
C24H27N5O3

>  <MolWeight> (49)
433.50288

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ACY-1215

>  <Synonyms> (49)
N/A

>  <Target> (49)
HDAC

>  <Form> (49)
Free Base

>  <CAS> (49)
1316214-52-4

>  <URL> (49)
http://www.selleckchem.com/products/rocilinostat-acy-1215.html

$$$$
Tenovin-1.cdx
csChFnd80/06042113042D

 26 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (50)
2323

>  <Formula> (50)
C20H23N3O2S

>  <MolWeight> (50)
369.48052

>  <Cat> (50)
S8000

>  <Name> (50)
Tenovin-1

>  <Synonyms> (50)
N/A

>  <Target> (50)
p53

>  <Form> (50)
Free Base

>  <CAS> (50)
380315-80-0

>  <URL> (50)
http://www.selleckchem.com/products/tenovin-1.html

$$$$
(+)-JQ1.cdx
csChFnd80/06042113042D

 31 34  0  0  0  0  0  0  0  0999 V2000
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 28 31  1  0  0  0  0
 10 24  1  6  0  0  0
M  END
>  <Mol_ID> (51)
2352

>  <Formula> (51)
C23H25ClN4O2S

>  <MolWeight> (51)
456.9882

>  <Cat> (51)
S7110

>  <Name> (51)
(+)-JQ1

>  <Synonyms> (51)
N/A

>  <Target> (51)
BET

>  <Form> (51)
Free Base

>  <CAS> (51)
1268524-70-4

>  <URL> (51)
http://www.selleckchem.com/products/jq1.html

$$$$
GSK J4 HCL.cdx
csChFnd80/06042113042D

 32 34  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (52)
2353

>  <Formula> (52)
C24H28ClN5O2

>  <MolWeight> (52)
453.96442

>  <Cat> (52)
S7070

>  <Name> (52)
GSK J4 HCl

>  <Synonyms> (52)
N/A

>  <Target> (52)
Histone Demethylase

>  <Form> (52)
Hydrochloride

>  <CAS> (52)
1373423-53-0(free base)

>  <URL> (52)
http://www.selleckchem.com/products/gsk-j4-hcl.html

$$$$
Sodium butyrate.cdx
csChFnd80/06042113042D

  7  5  0  0  0  0  0  0  0  0999 V2000
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  4  7  2  0  0  0  0
M  END
>  <Mol_ID> (53)
2425

>  <Formula> (53)
C4H7NaO2

>  <MolWeight> (53)
110.08695

>  <Cat> (53)
S1999

>  <Name> (53)
Sodium butyrate

>  <Synonyms> (53)
Butyric acid sodium salt

>  <Target> (53)
HDAC

>  <Form> (53)
Sodium Salt

>  <CAS> (53)
156-54-7

>  <URL> (53)
http://www.selleckchem.com/products/Sodium-butyrate.html

$$$$
CPI-169.cdx
csChFnd80/06042113042D

 37 40  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (54)
2490

>  <Formula> (54)
C27H36N4O5S

>  <MolWeight> (54)
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>  <Cat> (54)
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>  <Name> (54)
CPI-169

>  <Synonyms> (54)
N/A

>  <Target> (54)
Histone Methyltransferase

>  <Form> (54)
Free Base

>  <CAS> (54)
1450655-76-1

>  <URL> (54)
http://www.selleckchem.com/products/cpi-169.html

$$$$
AMI-1.cdx
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M  END
>  <Mol_ID> (55)
2504

>  <Formula> (55)
C21H14N2Na2O9S2

>  <MolWeight> (55)
548.4534

>  <Cat> (55)
S7884

>  <Name> (55)
AMI-1

>  <Synonyms> (55)
N/A

>  <Target> (55)
Histone Methyltransferase

>  <Form> (55)
disodium salt

>  <CAS> (55)
20324-87-2

>  <URL> (55)
http://www.selleckchem.com/products/ami-1.html

$$$$
GSK503.cdx
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>  <Mol_ID> (56)
2521

>  <Formula> (56)
C31H38N6O2

>  <MolWeight> (56)
526.67242

>  <Cat> (56)
S7804

>  <Name> (56)
GSK503

>  <Synonyms> (56)
N/A

>  <Target> (56)
Histone Methyltransferase

>  <Form> (56)
Free Base

>  <CAS> (56)
1346572-63-1

>  <URL> (56)
http://www.selleckchem.com/products/gsk503.html

$$$$
CPI-360.cdx
csChFnd80/06042113042D

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>  <Mol_ID> (57)
2528

>  <Formula> (57)
C25H31N3O4

>  <MolWeight> (57)
437.53134

>  <Cat> (57)
S7656

>  <Name> (57)
CPI-360

>  <Synonyms> (57)
N/A

>  <Target> (57)
Histone Methyltransferase

>  <Form> (57)
Free Base

>  <CAS> (57)
1802175-06-9

>  <URL> (57)
http://www.selleckchem.com/products/cpi-360.html

$$$$
GSK2801.cdx
csChFnd80/06042113042D

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2538

>  <Formula> (58)
C20H21NO4S

>  <MolWeight> (58)
371.45004

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S7231

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GSK2801

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N/A

>  <Target> (58)
Epigenetic Reader Domain

>  <Form> (58)
Free Base

>  <CAS> (58)
1619994-68-1

>  <URL> (58)
http://www.selleckchem.com/products/gsk2801.html

$$$$
SirReal2.cdx
csChFnd80/06042113042D

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M  END
>  <Mol_ID> (59)
2552

>  <Formula> (59)
C22H20N4OS2

>  <MolWeight> (59)
420.5504

>  <Cat> (59)
S7845

>  <Name> (59)
SirReal2

>  <Synonyms> (59)
N/A

>  <Target> (59)
Sirtuin

>  <Form> (59)
Free Base

>  <CAS> (59)
709002-46-0

>  <URL> (59)
http://www.selleck.cn/products/sirreal2.html

$$$$
CBL0137(CBL-0137).cdx
csChFnd80/06042113042D

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>  <Mol_ID> (60)
2560

>  <Formula> (60)
C21H25ClN2O2

>  <MolWeight> (60)
372.8884

>  <Cat> (60)
S8483

>  <Name> (60)
CBL0137(CBL-0137)

>  <Synonyms> (60)
CBLC137, Curaxin 137

>  <Target> (60)
FACT,p53,NF-¦ÊB 

>  <Form> (60)
hydrochloride

>  <CAS> (60)
1197397-89-9

>  <URL> (60)
http://www.selleckchem.com/products/cbl0137-cbl-0137.html

$$$$
S3944 Valproic acid.cdx
csChFnd80/06042113042D

 10  9  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (61)
2566

>  <Formula> (61)
C8H16O2

>  <MolWeight> (61)
144.21144

>  <Cat> (61)
S3944

>  <Name> (61)
Valproic acid

>  <Synonyms> (61)
2-Propylvaleric Acid, Sodium valproate

>  <Target> (61)
HDAC1

>  <Form> (61)
free base

>  <CAS> (61)
99-66-1

>  <URL> (61)
http://www.selleckchem.com/products/valproic-acid.html

$$$$
WT161.cdx
csChFnd80/06042113042D

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>  <Mol_ID> (62)
2596

>  <Formula> (62)
C27H30N4O3

>  <MolWeight> (62)
458.5521

>  <Cat> (62)
S8495

>  <Name> (62)
WT161

>  <Synonyms> (62)
N/A

>  <Target> (62)
HDAC1,2,6

>  <Form> (62)
free base

>  <CAS> (62)
1206731-57-8

>  <URL> (62)
http://www.selleckchem.com/products/wt161.html

$$$$
Bromosporine.cdx
csChFnd80/06042113042D

 28 30  0  0  0  0  0  0  0  0999 V2000
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Bromosporine

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>  <Target> (63)
Epigenetic Reader Domain

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Free Base

>  <URL> (63)
http://www.selleckchem.com/products/bromosporine.html

$$$$
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csChFnd80/06042113042D

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2610

>  <Formula> (64)
C32H37N5O3

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539.66788

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S7004

>  <Name> (64)
EPZ005687

>  <Synonyms> (64)
N/A

>  <Target> (64)
Histone Methyltransferase

>  <Form> (64)
Free Base

>  <CAS> (64)
1396772-26-1

>  <URL> (64)
http://www.selleckchem.com/products/epz005687.html

$$$$
GSK525762 (I-BET-762).cdx
csChFnd80/06042113042D

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2623

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C22H22ClN5O2

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423.89538

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S7189

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I-BET-762

>  <Synonyms> (65)
GSK525762, GSK525762A

>  <Target> (65)
Epigenetic Reader Domain

>  <Form> (65)
Free Base

>  <CAS> (65)
1260907-17-2

>  <URL> (65)
http://www.selleckchem.com/products/i-bet-762.html

$$$$
RGFP966.cdx
csChFnd80/06042113042D

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>  <Mol_ID> (66)
2629

>  <Formula> (66)
C21H19FN4O

>  <MolWeight> (66)
362.4001632

>  <Cat> (66)
S7229

>  <Name> (66)
RGFP966

>  <Synonyms> (66)
N/A

>  <Target> (66)
HDAC

>  <Form> (66)
Free Base

>  <CAS> (66)
1396841-57-8

>  <URL> (66)
http://www.selleckchem.com/products/rgfp966.html

$$$$
SGC 0946.cdx
csChFnd80/06042113042D

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>  <Mol_ID> (67)
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>  <Formula> (67)
C28H40BrN7O4

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>  <Cat> (67)
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>  <Name> (67)
SGC 0946

>  <Synonyms> (67)
N/A

>  <Target> (67)
Histone Methyltransferase

>  <Form> (67)
Free Base

>  <URL> (67)
http://www.selleckchem.com/products/sgc-0946.html

$$$$
EPZ-6438 (E7438).cdx
csChFnd80/06042113042D

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M  END
>  <Mol_ID> (68)
2709

>  <Formula> (68)
C34H44N4O4

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572.73756

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S7128

>  <Name> (68)
Tazemetostat (EPZ-6438)

>  <Synonyms> (68)
E7438

>  <Target> (68)
Histone Methyltransferase

>  <Form> (68)
Free Base

>  <CAS> (68)
1403254-99-8

>  <URL> (68)
http://www.selleckchem.com/products/epz-6438.html

$$$$
RVX-208(RVX-000222).cdx
csChFnd80/06042113042D

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M  END
>  <Mol_ID> (69)
2711

>  <Formula> (69)
C20H22N2O5

>  <MolWeight> (69)
370.39908

>  <Cat> (69)
S7295

>  <Name> (69)
RVX-208(RVX-000222)

>  <Synonyms> (69)
RVX-000222

>  <Target> (69)
Epigenetic Reader Domain

>  <Form> (69)
Free Base

>  <CAS> (69)
1044870-39-4

>  <URL> (69)
http://www.selleckchem.com/products/rvx-208.html

$$$$
UNC1999.cdx
csChFnd80/06042113042D

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Histone Methyltransferase

>  <Form> (70)
Free Base

>  <CAS> (70)
1431612-23-5

>  <URL> (70)
http://www.selleckchem.com/products/unc1999.html

$$$$
JIB04 (NSC693627).cdx
csChFnd80/06042113042D

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2720

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C17H13ClN4

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JIB04 (NSC693627)

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NSC693627

>  <Target> (71)
Histone demethylases

>  <Form> (71)
Free Base

>  <CAS> (71)
199596-05-9

>  <URL> (71)
http://www.selleckchem.com/products/jib-04.html

$$$$
MM-102.cdx
csChFnd80/06042113042D

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>  <Mol_ID> (72)
2725

>  <Formula> (72)
C35H49F2N7O4

>  <MolWeight> (72)
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>  <Cat> (72)
S7265

>  <Name> (72)
MM-102

>  <Synonyms> (72)
HMTase Inhibitor IX

>  <Target> (72)
Histone Methyltransferase

>  <Form> (72)
Free Base

>  <CAS> (72)
1417329-24-8

>  <URL> (72)
http://www.selleckchem.com/products/mm-102.html

$$$$
RG2833 (RGFP109).cdx
csChFnd80/06042113042D

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>  <Mol_ID> (73)
2730

>  <Formula> (73)
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>  <Name> (73)
RG2833 (RGFP109)

>  <Synonyms> (73)
N/A

>  <Target> (73)
HDAC

>  <Form> (73)
Free Base

>  <CAS> (73)
1215493-56-3

>  <URL> (73)
http://www.selleckchem.com/products/rg2833-rgfp109.html

$$$$
SGC-CBP30.cdx
csChFnd80/06042113042D

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1415800-43-9

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http://www.selleckchem.com/products/nuc1215.html

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5852-78-8

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http://www.selleckchem.com/products/iox1.html

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1446144-04-2

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1314890-29-3

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http://www.selleckchem.com/products/tmp269.html

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Histone Acetyltransferase

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Free Base

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1243583-85-8

>  <URL> (85)
http://www.selleckchem.com/products/mg149.html

$$$$
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HDAC

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1477949-42-0

>  <URL> (86)
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    2.4249    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0622    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    5.6000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    7.7000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    7.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  8 11  2  0  0  0  0
 10 12  1  0  0  0  0
  6 13  1  0  0  0  0
 13 14  1  0  0  0  0
  7 15  1  0  0  0  0
  9 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  1  0  0  0  0
 17 20  1  0  0  0  0
 19 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 19  1  0  0  0  0
 23 26  1  0  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
 26 29  1  0  0  0  0
M  END
>  <Mol_ID> (88)
2897

>  <Formula> (88)
C20H17F3N2O4

>  <MolWeight> (88)
406.3551896

>  <Cat> (88)
S7617

>  <Name> (88)
Tasquinimod

>  <Synonyms> (88)
ABR-215050

>  <Target> (88)
HDAC

>  <Form> (88)
Free Base

>  <CAS> (88)
254964-60-8

>  <URL> (88)
http://www.selleckchem.com/products/tasquinimod.html

$$$$
AGK 2.cdx
csChFnd80/06042113042D

 30 33  0  0  0  0  0  0  0  0999 V2000
    7.8229    2.3401    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4563    3.5832    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5828    1.1701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3426    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.8451    3.6588    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.6965    4.7533    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5427    4.8670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9382    4.8797    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6294    6.0973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9205    7.3046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5206    7.2943    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8294    6.0768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6471    3.6725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0470    3.6827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.4297    2.2671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6699    3.4372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  1  0  0  0  0
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  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  5  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12  7  1  0  0  0  0
  8 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16  9  1  0  0  0  0
  1 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
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 22 18  1  0  0  0  0
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 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
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 27 28  2  0  0  0  0
 28 23  1  0  0  0  0
 28 29  1  0  0  0  0
 25 30  1  0  0  0  0
M  END
>  <Mol_ID> (89)
2898

>  <Formula> (89)
C23H13Cl2N3O2

>  <MolWeight> (89)
434.27422

>  <Cat> (89)
S7577

>  <Name> (89)
AGK2

>  <Synonyms> (89)
N/A

>  <Target> (89)
Sirtuin

>  <Form> (89)
Free Base

>  <CAS> (89)
304896-28-4

>  <URL> (89)
http://www.selleckchem.com/products/agk2.html

$$$$
Anacardic Acid.cdx
csChFnd80/06042113042D

 25 25  0  0  0  0  0  0  0  0999 V2000
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6373    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8497    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2746    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6114    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  6  7  1  0  0  0  0
  5  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
  4 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
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 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (90)
2899

>  <Formula> (90)
C22H36O3

>  <MolWeight> (90)
348.51944

>  <Cat> (90)
S7582

>  <Name> (90)
Anacardic Acid

>  <Synonyms> (90)
6-pentadecylsalicylic Acid

>  <Target> (90)
Histone Acetyltransferase

>  <Form> (90)
Free Base

>  <CAS> (90)
16611-84-0

>  <URL> (90)
http://www.selleckchem.com/products/anacardic-acid.html

$$$$
Splitomicin.cdx
csChFnd80/06042113042D

 15 17  0  0  0  0  0  0  0  0999 V2000
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8497    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
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  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
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 10  5  1  0  0  0  0
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 14  1  1  0  0  0  0
 13 15  2  0  0  0  0
M  END
>  <Mol_ID> (91)
2904

>  <Formula> (91)
C13H10O2

>  <MolWeight> (91)
198.2173

>  <Cat> (91)
S7593

>  <Name> (91)
Splitomicin

>  <Synonyms> (91)
N/A

>  <Target> (91)
Sirtuin

>  <Form> (91)
Free Base

>  <CAS> (91)
1384339

>  <URL> (91)
http://www.selleckchem.com/products/splitomicin.html

$$$$
PFI-2.cdx
csChFnd80/06042113042D

 34 37  0  0  0  0  0  0  0  0999 V2000
    2.4249    3.5544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6373    4.2544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.2544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.5544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1544    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    1.4544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9119    4.2544    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   12.1244   10.5544    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119   11.2544    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
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 10  2  1  0  0  0  0
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 15 16  2  0  0  0  0
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 12 18  2  0  0  0  0
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 14 20  1  6  0  0  0
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M  END
>  <Mol_ID> (92)
2908

>  <Formula> (92)
C23H25F4N3O3S

>  <MolWeight> (92)
499.5215128

>  <Cat> (92)
S7294

>  <Name> (92)
PFI-2 HCl

>  <Synonyms> (92)
N/A

>  <Target> (92)
Histone Methyltransferase

>  <Form> (92)
Hydrochloride

>  <CAS> (92)
1627676-59-8

>  <URL> (92)
http://www.selleckchem.com/products/pfi-2.html

$$$$
MI-3.cdx
csChFnd80/06042113042D

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M  END
>  <Mol_ID> (93)
2909

>  <Formula> (93)
C18H25N5S2

>  <MolWeight> (93)
375.5546

>  <Cat> (93)
S7619

>  <Name> (93)
MI-3 (Menin-MLL Inhibitor)

>  <Synonyms> (93)
N/A

>  <Target> (93)
Histone Methyltransferase

>  <Form> (93)
Free Base

>  <CAS> (93)
1271738-59-0

>  <URL> (93)
http://www.selleckchem.com/products/mi-3-menin-mll-inhibitor.html

$$$$
Remodelin.cdx
csChFnd80/06042113042D

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M  CFW  16 B_NG_STER 2
M  END
>  <Mol_ID> (94)
2911

>  <Formula> (94)
C15H15BrN4S

>  <MolWeight> (94)
363.2754

>  <Cat> (94)
S7641

>  <Name> (94)
Remodelin

>  <Synonyms> (94)
N/A

>  <Target> (94)
Histone Acetyltransferase

>  <Form> (94)
hydrochloride salt

>  <CAS> (94)
1622921-15-6

>  <URL> (94)
http://www.selleckchem.com/products/remodelin.html

$$$$
MI-2 (Menin-MLL inhibitor).cdx
csChFnd80/06042113042D

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M  END
>  <Mol_ID> (95)
2934

>  <Formula> (95)
C18H25N5S2

>  <MolWeight> (95)
375.5546

>  <Cat> (95)
S7618

>  <Name> (95)
MI-2 (Menin-MLL inhibitor)

>  <Synonyms> (95)
N/A

>  <Target> (95)
Histone Methyltransferase

>  <Form> (95)
Free Base

>  <CAS> (95)
1271738-62-5

>  <URL> (95)
http://www.selleckchem.com/products/mi-2-menin-mll-inhibitor.html

$$$$
SP2509.cdx
csChFnd80/06042113042D

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>  <Mol_ID> (96)
2941

>  <Formula> (96)
C19H20ClN3O5S

>  <MolWeight> (96)
437.8972

>  <Cat> (96)
S7680

>  <Name> (96)
SP2509

>  <Synonyms> (96)
N/A

>  <Target> (96)
Histone Demethylase

>  <Form> (96)
Free Base

>  <CAS> (96)
1423715-09-6

>  <URL> (96)
http://www.selleckchem.com/products/sp2509.html

$$$$
GSK1324726A (I-BET726).cdx
csChFnd80/06042113042D

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1418308-27-6

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Histone Methyltransferase

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1374601-40-7

>  <URL> (99)
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>  <Mol_ID> (106)
2972

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C17H18BrN3O4S

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440.31152

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OF-1

>  <Synonyms> (106)
N/A

>  <Target> (106)
Epigenetic Reader Domain

>  <Form> (106)
Free Base

>  <CAS> (106)
919973-83-4

>  <URL> (106)
http://www.selleckchem.com/products/of-1.html

$$$$
UNC0379.cdx
csChFnd80/06042113042D

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>  <Mol_ID> (107)
2994

>  <Formula> (107)
C23H35N5O2

>  <MolWeight> (107)
413.5563

>  <Cat> (107)
S7570

>  <Name> (107)
UNC0379

>  <Synonyms> (107)
N/A

>  <Target> (107)
Histone Methyltransferase

>  <Form> (107)
Free Base

>  <CAS> (107)
1620401-82-2

>  <URL> (107)
http://www.selleckchem.com/products/unc0379.html

$$$$
GSK-LSD1  dihydrochloride.cdx
csChFnd80/06042113042D

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>  <Mol_ID> (108)
2996

>  <Formula> (108)
C14H22Cl2N2

>  <MolWeight> (108)
289.24388

>  <Cat> (108)
S7574

>  <Name> (108)
GSK-LSD1 2HCl

>  <Synonyms> (108)
N/A

>  <Target> (108)
Histone Demethylase

>  <Form> (108)
Dihydrochloride

>  <CAS> (108)
1431368-48-7

>  <URL> (108)
http://www.selleckchem.com/products/gsk-lsd1-2hcl.html

$$$$
GSK126.cdx
csChFnd80/06042113042D

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>  <Mol_ID> (109)
2999

>  <Formula> (109)
C31H38N6O2

>  <MolWeight> (109)
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>  <Cat> (109)
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>  <Name> (109)
GSK126

>  <Synonyms> (109)
N/A

>  <Target> (109)
Histone Methyltransferase

>  <Form> (109)
Free Base

>  <CAS> (109)
1346574-57-9

>  <URL> (109)
http://www.selleckchem.com/products/gsk126.html

$$$$
EPZ015666.cdx
csChFnd80/06042113042D

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S7748

>  <Name> (110)
EPZ015666

>  <Synonyms> (110)
N/A

>  <Target> (110)
Histone Methyltransferase

>  <Form> (110)
Free Base

>  <CAS> (110)
1616391-65-1

>  <URL> (110)
http://www.selleckchem.com/products/epz015666.html

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Sirtuin

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1093403-33-8

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HDAC

>  <Form> (112)
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>  <CAS> (112)
1440209-96-0

>  <URL> (112)
http://www.selleckchem.com/products/brd73954.html

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Histone Demethylase

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1373422-53-7

>  <URL> (113)
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M  END
>  <Mol_ID> (115)
3068

>  <Formula> (115)
C21H24N4O3

>  <MolWeight> (115)
380.44026

>  <Cat> (115)
S7906

>  <Name> (115)
PFI-4

>  <Synonyms> (115)
N/A

>  <Target> (115)
Epigenetic Reader Domain

>  <Form> (115)
Free Base

>  <CAS> (115)
900305-37-5

>  <URL> (115)
http://www.selleckchem.com/products/pfi-4.html

$$$$
ORY-1001.cdx
csChFnd80/06042113042D

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>  <Mol_ID> (116)
3085

>  <Formula> (116)
C15H24Cl2N2

>  <MolWeight> (116)
303.27046

>  <Cat> (116)
S7795

>  <Name> (116)
ORY-1001 (RG-6016) 2HCl

>  <Synonyms> (116)
N/A

>  <Target> (116)
Histone Demethylase

>  <Form> (116)
Dihydrochloride

>  <CAS> (116)
1431326-61-2

>  <URL> (116)
http://www.selleckchem.com/products/ory-1001-rg-6016.html

$$$$
SGC707.cdx
csChFnd80/06042113042D

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M  END
>  <Mol_ID> (117)
3113

>  <Formula> (117)
C16H18N4O2

>  <MolWeight> (117)
298.33972

>  <Cat> (117)
S7832

>  <Name> (117)
SGC707

>  <Synonyms> (117)
N/A

>  <Target> (117)
Histone Methyltransferase

>  <Form> (117)
Free Base

>  <CAS> (117)
1687736-54-4

>  <URL> (117)
http://www.selleckchem.com/products/sgc707.html

$$$$
GSK2879552.cdx
csChFnd80/06042113042D

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>  <Mol_ID> (118)
3123

>  <Formula> (118)
C23H30Cl2N2O2

>  <MolWeight> (118)
437.4025

>  <Cat> (118)
S7796

>  <Name> (118)
GSK2879552 2HCl

>  <Synonyms> (118)
N/A

>  <Target> (118)
Histone Demethylase

>  <Form> (118)
Dihydrochloride

>  <CAS> (118)
1401966-69-5

>  <URL> (118)
http://www.selleckchem.com/products/gsk2879552-2hcl.html

$$$$
MS023.cdx
csChFnd80/06042113042D

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M  END
>  <Mol_ID> (119)
3129

>  <Formula> (119)
C17H25N3O

>  <MolWeight> (119)
287.3999

>  <Cat> (119)
S8112

>  <Name> (119)
MS023

>  <Synonyms> (119)
N/A

>  <Target> (119)
Histone Methyltransferase

>  <Form> (119)
Free Base

>  <CAS> (119)
1831110-54-3

>  <URL> (119)
http://www.selleckchem.com/products/ms023.html

$$$$
Chaetocin.cdx
csChFnd80/06042113042D

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 21 47  2  0  0  0  0
 18 48  2  0  0  0  0
M  END
>  <Mol_ID> (120)
3131

>  <Formula> (120)
C30H28N6O6S4

>  <MolWeight> (120)
696.83992

>  <Cat> (120)
S8068

>  <Name> (120)
Chaetocin

>  <Synonyms> (120)
N/A

>  <Target> (120)
Histone Methyltransferase

>  <Form> (120)
Free Base

>  <CAS> (120)
28097-03-2

>  <URL> (120)
http://www.selleckchem.com/products/chaetocin.html

$$$$
PF-CBP1.cdx
csChFnd80/06042113042D

 37 40  0  0  0  0  0  0  0  0999 V2000
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 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
M  END
>  <Mol_ID> (121)
3151

>  <Formula> (121)
C29H37ClN4O3

>  <MolWeight> (121)
525.08208

>  <Cat> (121)
S8180

>  <Name> (121)
PF-CBP1 HCL

>  <Synonyms> (121)
N/A

>  <Target> (121)
Epigenetic Reader Domain

>  <Form> (121)
Hydrochloride

>  <URL> (121)
http://www.selleckchem.com/products/pf-cbp1.html

$$$$
GSK591 (EPZ015866, GSK3203591).cdx
csChFnd80/06042113042D

 28 31  0  0  0  0  0  0  0  0999 V2000
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  2  3  1  0  0  0  0
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  5  9  1  0  0  0  0
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 10 12  1  0  0  0  0
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 25 20  1  0  0  0  0
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 27 28  1  0  0  0  0
 28  8  1  0  0  0  0
M  END
>  <Mol_ID> (122)
3154

>  <Formula> (122)
C22H28N4O2

>  <MolWeight> (122)
380.48332

>  <Cat> (122)
S8111

>  <Name> (122)
GSK591 (EPZ015866,GSK3203591)

>  <Synonyms> (122)
EPZ015866, GSK3203591

>  <Target> (122)
Histone Methyltransferase

>  <Form> (122)
Free Base

>  <CAS> (122)
1616391-87-7

>  <URL> (122)
http://www.selleckchem.com/products/gsk591-epz015866-gsk3203591.html

$$$$
HLCL-61.cdx
csChFnd80/06042113042D

 27 29  0  0  0  0  0  0  0  0999 V2000
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    0.0000    6.3840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
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 13  9  1  0  0  0  0
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 14 15  1  0  0  0  0
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 18 23  1  0  0  0  0
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  7 25  1  0  0  0  0
 25 26  1  0  0  0  0
M  END
>  <Mol_ID> (123)
3159

>  <Formula> (123)
C23H25ClN2O

>  <MolWeight> (123)
380.9104

>  <Cat> (123)
S8209

>  <Name> (123)
HLCL-61 hydrochloride

>  <Synonyms> (123)
HLCL61

>  <Target> (123)
Histone Methyltransferase

>  <Form> (123)
Hydrochloride

>  <CAS> (123)
1158279-20-9

>  <URL> (123)
http://www.selleckchem.com/products/hlcl-61-hydrochloride.html

$$$$
I-BRD9 (GSK602).cdx
csChFnd80/06042113042D

 33 36  0  0  0  0  0  0  0  0999 V2000
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    3.6373    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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2098902-68-0

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Epigenetic Reader Domain

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Free Base

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1883429-21-7

>  <URL> (126)
http://www.selleckchem.com/products/bi-7273.html

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>  <URL> (127)
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CPI-637

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N/A

>  <Target> (133)
Epigenetic Reader Domain

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Free Base

>  <CAS> (133)
1884712-47-3

>  <URL> (133)
http://www.selleckchem.com/products/cpi-637.html

$$$$
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3302

>  <Formula> (134)
C29H32F3N5O3

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555.5912896

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S7833

>  <Name> (134)
OICR-9429

>  <Synonyms> (134)
N/A

>  <Target> (134)
Histone Methyltransferase

>  <Form> (134)
Free Base

>  <CAS> (134)
1801787-56-3

>  <URL> (134)
http://www.selleckchem.com/products/oicr-9429.html

$$$$
CPI-1205.cdx
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>  <Mol_ID> (135)
3306

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C27H33F3N4O3

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>  <Cat> (135)
S8353

>  <Name> (135)
CPI-1205

>  <Synonyms> (135)
CPI 1205, CPI1205

>  <Target> (135)
Histone Methyltransferase

>  <Form> (135)
Free Base

>  <CAS> (135)
1621862-70-1

>  <URL> (135)
http://www.selleckchem.com/products/cpi-1205.html

$$$$

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3312

>  <Formula> (136)
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BML210/CAY10433

>  <Synonyms> (136)
N/A

>  <Target> (136)
HDAC

>  <Form> (136)
Free Base

>  <CAS> (136)
537034-17-6

>  <URL> (136)
http://www.selleck.cn/products/bml210-cay10433.html

$$$$
CPI-455.cdx
csChFnd80/06042113042D

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>  <Mol_ID> (137)
3320

>  <Formula> (137)
C16H15ClN4O

>  <MolWeight> (137)
314.7695

>  <Cat> (137)
S8287

>  <Name> (137)
CPI-455 HCl

>  <Synonyms> (137)
N/A

>  <Target> (137)
Histone Demethylase

>  <Form> (137)
hydrochloride

>  <CAS> (137)
1628208-23-0(free base)

>  <URL> (137)
http://www.selleckchem.com/products/cpi-455.html

$$$$
UNC3866.cdx
csChFnd80/06042113042D

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>  <Mol_ID> (138)
3327

>  <Formula> (138)
C43H66N6O8

>  <MolWeight> (138)
795.01954

>  <Cat> (138)
S8359

>  <Name> (138)
UNC3866

>  <Synonyms> (138)
Free Base

>  <Target> (138)
Histone Methyltransferase

>  <Form> (138)
Free Base

>  <CAS> (138)
1872382-47-2

>  <URL> (138)
http://www.selleckchem.com/products/unc3866.html

$$$$
MS049.cdx
csChFnd80/06042113042D

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>  <Mol_ID> (139)
3339

>  <Formula> (139)
C15H26Cl2N2O

>  <MolWeight> (139)
321.28574

>  <Cat> (139)
S8147

>  <Name> (139)
MS049

>  <Synonyms> (139)
N/A

>  <Target> (139)
Histone Methyltransferase

>  <Form> (139)
dihydrochloride

>  <CAS> (139)
1502816-23-0(free base)

>  <URL> (139)
http://www.selleckchem.com/products/ms049.html

$$$$
SRT2183.cdx
csChFnd80/06042113042D

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>  <Mol_ID> (140)
3345

>  <Formula> (140)
C27H24N4O2S

>  <MolWeight> (140)
468.57006

>  <Cat> (140)
S8270

>  <Name> (140)
SRT2183

>  <Synonyms> (140)
N/A

>  <Target> (140)
Sirtuin

>  <Form> (140)
Free Base

>  <CAS> (140)
1001908-89-9

>  <URL> (140)
http://www.selleckchem.com/products/srt2183.html

$$$$
UNC0638.cdx
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M  END
>  <Mol_ID> (141)
3347

>  <Formula> (141)
C30H47N5O2

>  <MolWeight> (141)
509.72648

>  <Cat> (141)
S8071

>  <Name> (141)
UNC0638

>  <Synonyms> (141)
N/A

>  <Target> (141)
Histone Methyltransferase

>  <Form> (141)
Free Base

>  <CAS> (141)
1255580-76-7

>  <URL> (141)
http://www.selleckchem.com/products/unc0638.html

$$$$
EPZ020411.cdx
csChFnd80/06042113042D

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>  <Mol_ID> (142)
3353

>  <Formula> (142)
C25H40Cl2N4O3

>  <MolWeight> (142)
515.5161

>  <Cat> (142)
S7820

>  <Name> (142)
EPZ020411 2HCl

>  <Synonyms> (142)
N/A

>  <Target> (142)
Histone Methyltransferase

>  <Form> (142)
dihydrochloride

>  <CAS> (142)
1700663-41-7(free base)

>  <URL> (142)
http://www.selleckchem.com/products/epz020411.html

$$$$
MI-463.cdx
csChFnd80/06042113042D

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>  <Mol_ID> (143)
3368

>  <Formula> (143)
C24H23F3N6S

>  <MolWeight> (143)
484.5398296

>  <Cat> (143)
S7816

>  <Name> (143)
MI-463

>  <Synonyms> (143)
N/A

>  <Target> (143)
Histone Methyltransferase

>  <Form> (143)
Free Base

>  <CAS> (143)
1628317-18-9

>  <URL> (143)
http://www.selleckchem.com/products/mi-463.html

$$$$
Thiomyristoyl.cdx
csChFnd80/06042113042D

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1105698-15-4

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1445993-26-9

>  <URL> (146)
http://www.selleckchem.com/products/mivebresib-abbv-075.html

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GSK6853.cdx
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Epigenetic Reader Domain

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Free Base

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1910124-24-1

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http://www.selleckchem.com/products/gsk6853.html

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3413

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C31H32ClN5O2S2

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>  <Name> (149)
SRT3025 HCl

>  <Synonyms> (149)
N/A

>  <Target> (149)
Sirtuin activator

>  <Form> (149)
hydrochloride

>  <CAS> (149)
2070015-26-6

>  <URL> (149)
http://www.selleckchem.com/products/srt3025.html

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EED226.cdx
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C17H15N5O3S

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EED226

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N/A

>  <Target> (150)
Epigenetic Reader Domain

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Free Base

>  <CAS> (150)
2083627-02-3

>  <URL> (150)
http://www.selleckchem.com/products/eed226.html

$$$$
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csChFnd80/06042113042D

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>  <Cat> (151)
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>  <Name> (151)
BIX 01294

>  <Synonyms> (151)
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>  <Target> (151)
Histone Methyltransferase

>  <Form> (151)
trihydrochloride

>  <CAS> (151)
1392399-03-9

>  <URL> (151)
http://www.selleckchem.com/products/bix-01294.html

$$$$
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1982372-88-2

>  <URL> (152)
http://www.selleckchem.com/products/a-196.html

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C19H24N2O2

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N/A

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CARM1

>  <Form> (153)
free base

>  <CAS> (153)
1821908-48-8

>  <URL> (153)
http://www.selleckchem.com/products/sgc2085.html

$$$$
TMP195.cdx
csChFnd80/06042113042D

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>  <Mol_ID> (154)
3441

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C23H19F3N4O3

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TMP195

>  <Synonyms> (154)
TFMO 2

>  <Target> (154)
HDAC9,HDAC7,HDAC4,HDAC5

>  <Form> (154)
free base

>  <CAS> (154)
1314891-22-9

>  <URL> (154)
http://www.selleckchem.com/products/tmp195.html

$$$$
SF2523.cdx
csChFnd80/06042113042D

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>  <Mol_ID> (155)
3450

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DNA-PK,PI3K¦Á,PI3K¦Ã ,BRD4,mTOR

>  <Form> (155)
free base

>  <CAS> (155)
1174428-47-7

>  <URL> (155)
http://www.selleckchem.com/products/sf2523.html

$$$$
Tucidinostat (Chidamide).cdx
csChFnd80/06042113042D

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Tucidinostat (Chidamide)

>  <Synonyms> (156)
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743420-02-2

>  <URL> (156)
http://www.selleckchem.com/products/tucidinostat-chidamide.html

$$$$
3-TYP.cdx
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N/A

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G9a,GLP

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free base

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1481677-78-4

>  <URL> (163)
http://www.selleckchem.com/products/unc0642.html

$$$$
JQ-EZ-05 (JQEZ5).cdx
csChFnd80/06042113042D

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N/A

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EZH1,EZH2

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1913252-04-6

>  <URL> (164)
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csChFnd80/06042113042D

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>  <Target> (165)
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free base

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1184136-10-4

>  <URL> (165)
http://selleckchem.com/products/unc-926.html

$$$$
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csChFnd80/06042113042D

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    4.9000    0.1876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1000    2.6124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1000    0.1876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3000    2.6124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.7000    2.6124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    0.1876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0000    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4000    1.4000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    8.4000    2.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
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  3  7  1  0  0  0  0
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 13 14  2  0  0  0  0
 13 15  2  0  0  0  0
 13 16  1  0  0  0  0
M  END
>  <Mol_ID> (166)
3908

>  <Formula> (166)
C12H9ClO2S

>  <MolWeight> (166)
252.71666

>  <Cat> (166)
S5438

>  <Name> (166)
Biphenyl-4-sulfonyl chloride

>  <Synonyms> (166)
p-Phenylbenzenesulfonyl chloride, 4-Phenylbenzenesulfonyl chloride, p-Biphenylsulfonyl chloride

>  <Target> (166)
HDAC

>  <Form> (166)
free base

>  <CAS> (166)
1623-93-4

>  <URL> (166)
http://selleckchem.com/products/biphenyl-4-sulfonyl-chloride.html

$$$$
S5445 AMI-1, free acid.cdx
csChFnd80/06042113042D

 34 37  0  0  0  0  0  0  0  0999 V2000
    4.8451    1.9141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8451    3.3142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6309    1.2130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4227    1.9106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.9730    1.9168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9729    3.3169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   19.3978    0.5169    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.4850    0.0037    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.8850    2.4286    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  3  7  1  0  0  0  0
  4  8  2  0  0  0  0
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  5 10  1  0  0  0  0
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  7 12  1  0  0  0  0
  7  9  2  0  0  0  0
  8 13  1  0  0  0  0
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 12 14  1  0  0  0  0
 12 15  2  0  0  0  0
 12 16  2  0  0  0  0
 13 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  2  0  0  0  0
 18 20  1  0  0  0  0
 20 21  2  0  0  0  0
 20 22  1  0  0  0  0
 21 23  1  0  0  0  0
 22 24  2  0  0  0  0
 23 25  1  0  0  0  0
 23 26  2  0  0  0  0
 24 25  1  0  0  0  0
 25 27  2  0  0  0  0
 26 28  1  0  0  0  0
 27 29  1  0  0  0  0
 27 30  1  0  0  0  0
 28 31  1  0  0  0  0
 28 29  2  0  0  0  0
 31 32  1  0  0  0  0
 31 33  2  0  0  0  0
 31 34  2  0  0  0  0
M  END
>  <Mol_ID> (167)
3913

>  <Formula> (167)
C21H16N2O9S2

>  <MolWeight> (167)
504.48974

>  <Cat> (167)
S5445

>  <Name> (167)
AMI-1, free acid

>  <Synonyms> (167)
N/A

>  <Target> (167)
Histone Methyltransferase

>  <Form> (167)
free base

>  <CAS> (167)
134-47-4

>  <URL> (167)
http://selleckchem.com/products/ami-1-free-acid.html

$$$$
S5500 Amodiaquine hydrochloride.cdx
csChFnd80/06042113042D

 27 27  0  0  0  0  0  0  0  0999 V2000
    3.6373    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    7.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2124    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    7.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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   12.1244    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  3  1  2  0  0  0  0
  4  1  1  0  0  0  0
  7  1  1  0  0  0  0
  2 10  2  0  0  0  0
 11  2  1  0  0  0  0
  2  9  1  0  0  0  0
  5  3  1  0  0  0  0
 16  3  1  0  0  0  0
  6  4  1  0  0  0  0
  8  4  2  0  0  0  0
 12  5  1  0  0  0  0
  6 14  2  0  0  0  0
 17  7  2  0  0  0  0
 18  8  1  0  0  0  0
  9 13  2  0  0  0  0
 21  9  1  0  0  0  0
 10 12  1  0  0  0  0
 15 11  1  0  0  0  0
 19 12  2  0  0  0  0
 13 19  1  0  0  0  0
 14 17  1  0  0  0  0
 20 14  1  0  0  0  0
 22 15  1  0  0  0  0
 23 15  1  0  0  0  0
 16 18  2  0  0  0  0
 25 22  1  0  0  0  0
 24 23  1  0  0  0  0
M  END
>  <Mol_ID> (168)
4062

>  <Formula> (168)
C20H24Cl3N3O

>  <MolWeight> (168)
428.78306

>  <Cat> (168)
S5500

>  <Name> (168)
Amodiaquine hydrochloride

>  <Synonyms> (168)
N/A

>  <Target> (168)
HnMT

>  <Form> (168)
dihydrochloride 

>  <CAS> (168)
69-44-3

>  <URL> (168)
http://selleckchem.com/products/.html

$$$$
S9432 Ginkgolic Acid.cdx
csChFnd80/06042113042D

 25 25  0  0  0  0  0  0  0  0999 V2000
    2.4156    4.2036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4156    2.8004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2109    4.8991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0035    4.2021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  4 10  2  0  0  0  0
  5 11  1  0  0  0  0
  6 12  1  0  0  0  0
  7 11  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (169)
4161

>  <Formula> (169)
C22H34O3

>  <MolWeight> (169)
346.50356

>  <Cat> (169)
S9432

>  <Name> (169)
Ginkgolic Acid

>  <Form> (169)
free base

>  <CAS> (169)
22910-60-7

$$$$
S9445 Ginkgolic Acid (C130).cdx
csChFnd80/06042113042D

 23 23  0  0  0  0  0  0  0  0999 V2000
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4249    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    8.4871    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.3368    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.9741    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
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  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  6 12  2  0  0  0  0
  7  9  2  0  0  0  0
  8 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (170)
4172

>  <Formula> (170)
C20H32O3

>  <MolWeight> (170)
320.46628

>  <Cat> (170)
S9445

>  <Name> (170)
Ginkgolic Acid (C130)

>  <Form> (170)
free base

>  <CAS> (170)
20261-38-5

$$$$

csChFnd80/06042113042D

 14 13  0  0  0  0  0  0  0  0999 V2000
   10.9527    2.0543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  5  7  1  0  0  0  0
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M  END
>  <Mol_ID> (171)
4210

>  <Formula> (171)
C8H16N2O4

>  <MolWeight> (171)
204.22364

>  <Cat> (171)
S5905

>  <Name> (171)
Suberohydroxamic acid

>  <Synonyms> (171)
suberic bishydroxamic acid

>  <Target> (171)
HDAC

>  <Form> (171)
Free Base

>  <CAS> (171)
38937-66-5

>  <URL> (171)
http://www.selleckchem.com/products/suberohydroxamic-acid.html

$$$$

csChFnd80/06042113042D

 26 29  0  0  0  0  0  0  0  0999 V2000
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 13  2  1  0  0  0  0
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 12  3  2  0  0  0  0
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 10  5  2  0  0  0  0
  5  6  1  0  0  0  0
  8  7  1  0  0  0  0
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 11  8  2  0  0  0  0
 14  9  1  0  0  0  0
 18  9  2  0  0  0  0
 15 11  1  0  0  0  0
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 26 24  2  0  0  0  0
M  END
>  <Mol_ID> (172)
4216

>  <Formula> (172)
C21H16N2O2S

>  <MolWeight> (172)
360.42894

>  <Cat> (172)
S5913

>  <Name> (172)
Cambinol

>  <Synonyms> (172)
N/A

>  <Target> (172)
TNF-alpha

>  <Form> (172)
Free Base

>  <CAS> (172)
14513-15-6

>  <URL> (172)
http://www.selleckchem.com/products/cambinol.html

$$$$

csChFnd80/06042113042D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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  3  4  2  0  0  0  0
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 10 11  1  0  0  0  0
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 17 18  2  0  0  0  0
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M  END
>  <Mol_ID> (173)
4217

>  <Formula> (173)
C19H21BrN2O3S

>  <MolWeight> (173)
437.35064

>  <Cat> (173)
S5914

>  <Name> (173)
AK 7

>  <Synonyms> (173)
N/A

>  <Target> (173)
Sirtuin

>  <Form> (173)
Free Base

>  <CAS> (173)
420831-40-9

>  <URL> (173)
http://www.selleckchem.com/products/ak-7.html

$$$$

csChFnd80/06042113042D

 29 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (174)
4219

>  <Formula> (174)
C22H26N4O3

>  <MolWeight> (174)
394.46684

>  <Cat> (174)
S5916

>  <Name> (174)
GSK 5959

>  <Synonyms> (174)
N/A

>  <Target> (174)
Epigenetic Reader Do

>  <Form> (174)
Free Base

>  <CAS> (174)
901245-65-6

>  <URL> (174)
http://www.selleckchem.com/products/gsk-5959.html

$$$$

csChFnd80/06042113042D

 30 34  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (175)
4221

>  <Formula> (175)
C22H15FN4O2S

>  <MolWeight> (175)
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>  <Cat> (175)
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>  <Name> (175)
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>  <Synonyms> (175)
N/A

>  <Target> (175)
Sirtuin

>  <Form> (175)
Free Base

>  <CAS> (175)
374922-43-7

>  <URL> (175)
http://www.selleckchem.com/products/cay10602.html

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18228-17-6

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2098546-05-3

>  <URL> (177)
http://www.selleckchem.com/products/ebi-2511.html

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 32 34  2  0  0  0  0
 33 35  1  0  0  0  0
 35 36  1  0  0  0  0
M  END
>  <Mol_ID> (179)
4255

>  <Formula> (179)
C28H30FN3O4

>  <MolWeight> (179)
491.5539032

>  <Cat> (179)
S8723

>  <Name> (179)
ABBV-744

>  <Synonyms> (179)
N/A

>  <Target> (179)
Epigenetic Reader Do

>  <Form> (179)
Free Base

>  <CAS> (179)
2138861-99-9

>  <URL> (179)
http://www.selleckchem.com/products/abbv-744.html

$$$$

csChFnd80/06042113042D

 22 24  0  0  0  0  0  0  0  0999 V2000
    1.2124    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4249    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2746    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2746    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9119    6.3000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  2  7  1  0  0  0  0
  6  8  1  0  0  0  0
  3  9  1  0  0  0  0
  5 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
 14 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 15  1  0  0  0  0
 20 22  2  0  0  0  0
M  END
>  <Mol_ID> (180)
4271

>  <Formula> (180)
C16H16N4O2

>  <MolWeight> (180)
296.32384

>  <Cat> (180)
S8763

>  <Name> (180)
ZL0420

>  <Synonyms> (180)
N/A

>  <Target> (180)
Epigenetic Reader Do

>  <Form> (180)
Free Base

>  <CAS> (180)
2229039-45-4

>  <URL> (180)
http://www.selleckchem.com/products/zl0420.html

$$$$
S9031 Gambogenic acid.cdx
csChFnd80/06042113042D

 46 50  0  0  0  0  0  0  0  0999 V2000
   12.1266    3.5018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1266    2.1024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3438    1.3994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5545    2.1024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5545    3.5018    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   13.3438    4.2048    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9159    4.2048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7052    3.5018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9159    1.3994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4879    4.2048    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2772    2.1024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4879    1.3994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9159    5.6044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7052    6.3008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7052    7.7002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9159    8.3968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4945    8.3968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9159    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3438    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7717    1.3994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9824    2.1024    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   15.7912    5.0576    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   16.9824    3.5018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1996    4.2048    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.9156    5.5392    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   18.9156    6.9387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2736    8.2926    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.2695    7.3033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6113    6.4961    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.0882    6.2747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8759    6.9741    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8776    8.3708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6654    9.0701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.9351    3.1830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0601    1.3994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8494    2.1024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0601    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6387    1.3994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4214    2.1024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2107    1.3994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.0958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2107    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0856    9.0715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0856   10.4715    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2982    8.3714    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  1  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  2  1  0  0  0  0
  8 11  1  0  0  0  0
 12 13  1  0  0  0  0
 13  9  1  0  0  0  0
  7 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  0  0  0  0
 10 19  1  0  0  0  0
  3 20  2  0  0  0  0
  4 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22 24  1  0  0  0  0
 24 23  1  0  0  0  0
 24 25  2  0  0  0  0
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 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 23 30  1  0  0  0  0
 30 27  1  0  0  0  0
 23 31  1  6  0  0  0
 31 32  1  0  0  0  0
 32 33  2  0  0  0  0
 33 34  1  0  0  0  0
 33 44  1  0  0  0  0
 22 35  1  1  0  0  0
 26 35  1  6  0  0  0
 12 36  2  0  0  0  0
 36 37  1  0  0  0  0
 36 38  1  0  0  0  0
 37 39  1  0  0  0  0
 39 40  1  0  0  0  0
 40 41  2  0  0  0  0
 41 42  1  0  0  0  0
 41 43  1  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  5 23  1  0  0  0  0
 44 45  2  0  0  0  0
 44 46  1  0  0  0  0
M  END
>  <Mol_ID> (181)
4286

>  <Formula> (181)
C38H46O8

>  <MolWeight> (181)
630.76704

>  <Cat> (181)
S9031

>  <Name> (181)
Gambogenic acid

>  <Form> (181)
free base

>  <CAS> (181)
173932-75-7

$$$$
S9275 Isoguanosine.cdx
csChFnd80/06042113042D

 20 22  0  0  0  0  0  0  0  0999 V2000
    3.6385    5.6609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9701    5.2281    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6385    7.0621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4251    4.9603    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.4023    3.8975    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.7930    6.3604    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9710    7.4936    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4244    7.7631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2121    5.6607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5757    2.7589    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7082    3.4744    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
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    7.8307    4.3013    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  5  2  1  1  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  5 11  1  0  0  0  0
  6  7  2  0  0  0  0
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  9 14  2  0  0  0  0
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 10 15  1  0  0  0  0
 11 16  1  0  0  0  0
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 15 18  1  1  0  0  0
 15 16  1  0  0  0  0
 16 19  1  6  0  0  0
 18 20  1  0  0  0  0
M  END
>  <Mol_ID> (182)
4473

>  <Formula> (182)
C10H13N5O5

>  <MolWeight> (182)
283.24072

>  <Cat> (182)
S9275

>  <Name> (182)
Isoguanosine

>  <Form> (182)
free base

>  <CAS> (182)
1818-71-9

$$$$
S9379 Dihydrocoumarin.cdx
csChFnd80/06042113042D

 11 12  0  0  0  0  0  0  0  0999 V2000
    2.4327    0.7057    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4293    2.0807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8468    0.7002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8456    2.0858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0016    2.0876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0592    0.0002    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
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  3  7  1  0  0  0  0
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  5  9  1  0  0  0  0
  6 10  2  0  0  0  0
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M  END
>  <Mol_ID> (183)
4644

>  <Formula> (183)
C9H8O2

>  <MolWeight> (183)
148.15862

>  <Cat> (183)
S9379

>  <Name> (183)
Dihydrocoumarin

>  <Form> (183)
free base

>  <CAS> (183)
119-84-6

$$$$
Tubastatin A hydrochloride.cdx
csChFnd80/06042113042D

 25 28  0  0  0  0  0  0  0  0999 V2000
    3.6247    3.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 23 25  1  0  0  0  0
M  END
>  <Mol_ID> (184)
4688

>  <Formula> (184)
C20H21N3O2

>  <MolWeight> (184)
335.39964

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>  <Name> (184)
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>  <Target> (184)
others

>  <CAS> (184)
1252003-15-8

>  <URL> (184)
https://www.selleckchem.com/products/tubastatin-a.html

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csChFnd80/06042113042D

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M  END
>  <Mol_ID> (185)
4807

>  <Formula> (185)
C6H11NOS2

>  <MolWeight> (185)
177.28764

>  <Cat> (185)
S5771

>  <Name> (185)
sulforaphane

>  <Synonyms> (185)
N/A

>  <Target> (185)
Nrf2

>  <Form> (185)
Free Base

>  <CAS> (185)
4478-93-7

>  <URL> (185)
http://www.selleckchem.com/products/sulforaphane.html

$$$$

csChFnd80/06042113042D

 22 24  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (186)
4808

>  <Formula> (186)
C17H13N3O2

>  <MolWeight> (186)
291.30402

>  <Cat> (186)
S5772

>  <Name> (186)
AS-8351

>  <Synonyms> (186)
N/A

>  <Target> (186)
Histone Demethylase

>  <Form> (186)
Free Base

>  <CAS> (186)
796-42-9

>  <URL> (186)
http://www.selleckchem.com/products/as-8351.html

$$$$

csChFnd80/06042113042D

 15 15  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (187)
4834

>  <Formula> (187)
C11H15BrN2O

>  <MolWeight> (187)
271.1536

>  <Cat> (187)
S5810

>  <Name> (187)
UF010

>  <Synonyms> (187)
N/A

>  <Target> (187)
HDAC

>  <Form> (187)
Free Base

>  <CAS> (187)
537672-41-6 

>  <URL> (187)
http://www.selleckchem.com/products/uf010.html

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csChFnd80/06042113042D

 19 20  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (188)
4857

>  <Formula> (188)
C15H16N2O2

>  <MolWeight> (188)
256.29974

>  <Cat> (188)
S8773

>  <Name> (188)
TH34

>  <Synonyms> (188)
N/A

>  <Target> (188)
HDAC

>  <Form> (188)
Free Base

>  <CAS> (188)
2196203-96-8

>  <URL> (188)
http://www.selleckchem.com/products/th34.html

$$$$

csChFnd80/06042113042D

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4859

>  <Formula> (189)
C18H13F2N3O3S

>  <MolWeight> (189)
389.3759264

>  <Cat> (189)
S8776

>  <Name> (189)
WM-1119

>  <Synonyms> (189)
N/A

>  <Target> (189)
Histone Acetyltransf

>  <Form> (189)
Free Base

>  <CAS> (189)
2055397-28-7

>  <URL> (189)
http://www.selleckchem.com/products/wm-1119.html

$$$$

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>  <Name> (190)
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>  <Synonyms> (190)
N/A

>  <Target> (190)
Epigenetic Reader Do

>  <Form> (190)
free base

>  <CAS> (190)
1799711-21-9

>  <URL> (190)
http://www.selleck.cn/products/bet1.html

$$$$

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>  <Mol_ID> (191)
5192

>  <Formula> (191)
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>  <Cat> (191)
S8762

>  <Name> (191)
dBET6

>  <Synonyms> (191)
N/A

>  <Target> (191)
Epigenetic Reader Do

>  <Form> (191)
free base

>  <CAS> (191)
1950634-92-0

>  <URL> (191)
http://www.selleck.cn/products/dbet6.html

$$$$

csChFnd80/06042113042D

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>  <Mol_ID> (192)
5256

>  <Formula> (192)
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>  <MolWeight> (192)
620.52234

>  <Cat> (192)
S8846

>  <Name> (192)
compound 3i (666-15)

>  <Synonyms> (192)
N/A

>  <Target> (192)
Epigenetic Reader Do

>  <Form> (192)
Free Base

>  <CAS> (192)
1433286-70-4

>  <URL> (192)
http://www.selleck.cn/products/compound-3i.html

$$$$

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5267

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1300031-49-5

>  <URL> (193)
http://www.selleck.cn/products/i-bet151-gsk1210151a.html

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C20H22ClN3O

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355.86118

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S5948

>  <Name> (194)
Amodiaquine

>  <Synonyms> (194)
N/A

>  <Target> (194)
Anti-infection

>  <Form> (194)
Free Base

>  <CAS> (194)
86-42-0

>  <URL> (194)
http://www.selleck.cn/products/amodiaquine.html

$$$$

csChFnd80/06042113042D

 22 23  0  0  0  0  0  0  0  0999 V2000
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M  END
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5342

>  <Formula> (195)
C17H18F2N2O

>  <MolWeight> (195)
304.3344264

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S2132

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SR4370

>  <Synonyms> (195)
N/A

>  <Target> (195)
HDAC

>  <Form> (195)
Free Base

>  <CAS> (195)
1816294-67-3

>  <URL> (195)
http://www.selleck.cn/products/sr4370.html

$$$$

csChFnd80/06042113042D

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>  <Mol_ID> (196)
5372

>  <Formula> (196)
C31H39N7O2

>  <MolWeight> (196)
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S7164

>  <Name> (196)
GSK343

>  <Synonyms> (196)
N/A

>  <Target> (196)
Histone Methyltransf

>  <Form> (196)
Free Base

>  <CAS> (196)
1346704-33-3

>  <URL> (196)
http://www.selleck.cn/products/gsk343.html

$$$$

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>  <MolWeight> (197)
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Epigenetic Reader Do

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Free Base

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1627929-55-8

>  <URL> (197)
http://www.selleck.cn/products/plx51107.html

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M  END
>  <Mol_ID> (198)
5380

>  <Formula> (198)
C19H16N4O3

>  <MolWeight> (198)
348.35534

>  <Cat> (198)
S8753

>  <Name> (198)
INCB054329£¨INCB-054329,INCB-54329£©

>  <Synonyms> (198)
N/A

>  <Target> (198)
Epigenetic Reader Do

>  <Form> (198)
Free Base

>  <CAS> (198)
1628607-64-6

>  <URL> (198)
http://www.selleck.cn/products/incb054329.html

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csChFnd80/06042113042D

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M  END
>  <Mol_ID> (199)
5381

>  <Formula> (199)
C19H28Cl2N4O2

>  <MolWeight> (199)
415.35722

>  <Cat> (199)
S8769

>  <Name> (199)
Tinostamustine(EDO-S101)

>  <Synonyms> (199)
N/A

>  <Target> (199)
HDAC

>  <Form> (199)
Free Base

>  <CAS> (199)
1236199-60-2

>  <URL> (199)
http://www.selleck.cn/products/tinostamustine.html

$$$$

csChFnd80/06042113042D

 24 26  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (200)
6722

>  <Formula> (200)
C18H23ClN4O

>  <MolWeight> (200)
346.85442

>  <Cat> (200)
S8438

>  <Name> (200)
T-3775440 HCl

>  <Synonyms> (200)
N/A

>  <Target> (200)
Histone Demethylase

>  <Form> (200)
HCl

>  <CAS> (200)
1422535-52-1

>  <URL> (200)
http://www.selleck.cn/products/t-3775440-hcl.html

$$$$

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   10.8918    0.0024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1000    6.2907    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3084    6.9883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4166    4.8953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2084    4.1976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.8952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 23 24  1  0  0  0  0
 26 27  1  0  0  0  0
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  5  6  1  0  0  0  0
  6  1  2  0  0  0  0
  4  7  1  0  0  0  0
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 10 11  1  0  0  0  0
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 14 25  1  0  0  0  0
 25 26  1  0  0  0  0
 25 28  2  0  0  0  0
M  END
>  <Mol_ID> (206)
6871

>  <Formula> (206)
C21H25N3O4

>  <MolWeight> (206)
383.4409

>  <Cat> (206)
S2184

>  <Name> (206)
WDR5-0103

>  <Synonyms> (206)
WD-Repeat Protein 5-0103

>  <Target> (206)
Histone Methyltransferase

>  <Form> (206)
Free Base

>  <CAS> (206)
890190-22-4

>  <URL> (206)
http://www.selleck.cn/products/wdr5-0103.html

$$$$

csChFnd80/06042113042D

 19 19  0  0  0  0  0  0  0  0999 V2000
    6.8543    2.7999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.6395    0.7013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.4948    2.1025    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    4.2845    4.1951    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.9154    4.4876    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.2142    3.2760    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.8217    3.1312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  1  6  2  0  0  0  0
  7  8  2  0  0  0  0
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  2  7  1  0  0  0  0
 10 11  1  0  0  0  0
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 13 17  1  1  0  0  0
 12 18  1  1  0  0  0
 11  6  1  6  0  0  0
M  END
>  <Mol_ID> (207)
6877

>  <Formula> (207)
C11H15ClN2O5

>  <MolWeight> (207)
290.7002

>  <Cat> (207)
S2935

>  <Name> (207)
Nicotinamide Riboside Chloride

>  <Synonyms> (207)
N/A

>  <Target> (207)
Others

>  <Form> (207)
Chloride

>  <CAS> (207)
23111-00-4

>  <URL> (207)
http://www.selleck.cn/products/nicotinamide-riboside-chloride.html

$$$$

csChFnd80/06042113042D

 24 25  0  0  0  0  0  0  0  0999 V2000
   12.1326    2.0955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9202    1.3955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7077    2.0955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4953    1.3955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2829    2.0955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0704    1.3955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8580    2.0955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1326    3.4955    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3450    1.3955    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   14.5575    2.0955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.9775    2.0968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.5715    3.4984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7663    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  1  8  2  0  0  0  0
  1  9  1  0  0  0  0
  7 10  2  0  0  0  0
  7 11  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 12 17  2  0  0  0  0
 11 12  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 18 23  2  0  0  0  0
 19 24  1  0  0  0  0
  9 18  1  0  0  0  0
M  END
>  <Mol_ID> (208)
6879

>  <Formula> (208)
C19H23N3O2

>  <MolWeight> (208)
325.40482

>  <Cat> (208)
S6548

>  <Name> (208)
NKL 22

>  <Synonyms> (208)
N/A

>  <Target> (208)
HDAC

>  <Form> (208)
Free Base

>  <CAS> (208)
537034-15-4

>  <URL> (208)
http://www.selleck.cn/products/nkl-22.html

$$$$

csChFnd80/06042113042D

 25 25  0  0  0  0  0  0  0  0999 V2000
    0.9400    2.2606    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.4358    3.7892    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8607    2.3892    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.6482    1.6892    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.5601    2.3892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3477    1.6892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7726    1.6892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1353    2.3892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9850    2.3892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9228    1.6892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1975    1.6892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.4099    2.3892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7104    2.3892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6223    1.6892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4980    1.6892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.8348    2.3892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   24.0472    1.6892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   25.2596    2.3892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4358    2.3892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1 22  1  0  0  0  0
  1 25  1  0  0  0  0
  2 21  2  0  0  0  0
  3  4  1  0  0  0  0
  3 19  1  0  0  0  0
  4 21  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  6  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
  9 11  1  0  0  0  0
 10 13  1  0  0  0  0
 11 12  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
M  END
>  <Mol_ID> (209)
6904

>  <Formula> (209)
C21H38N2OS

>  <MolWeight> (209)
366.60422

>  <Cat> (209)
S6687

>  <Name> (209)
SIS17

>  <Synonyms> (209)
N/A

>  <Target> (209)
HDAC

>  <Form> (209)
Free Base

>  <CAS> (209)
2374313-54-7

>  <URL> (209)
http://www.selleck.cn/products/sis17.html

$$$$

csChFnd80/06042113042D

 35 39  0  0  0  0  0  0  0  0999 V2000
    4.6225    5.8986    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6225    8.7661    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1360    4.5400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   10.7772   10.8324    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.7772   12.2324    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.9896   12.9324    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.7772    6.6324    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.8323    8.0615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9896    5.9324    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2685    6.5018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5053    4.2489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2053    5.4613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1 22  1  0  0  0  0
  1 26  1  0  0  0  0
  2 29  1  0  0  0  0
  2 34  1  0  0  0  0
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  4 18  1  0  0  0  0
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  5 14  1  0  0  0  0
  5 17  1  0  0  0  0
  6  8  1  0  0  0  0
  6 19  1  0  0  0  0
  7 24  1  0  0  0  0
  7 27  2  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
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 10 12  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 15 16  1  0  0  0  0
 17 20  1  0  0  0  0
 19 21  1  0  0  0  0
 19 23  2  0  0  0  0
 20 22  1  0  0  0  0
 21 24  1  0  0  0  0
 21 25  2  0  0  0  0
 23 27  1  0  0  0  0
 24 28  2  0  0  0  0
 25 29  1  0  0  0  0
 26 28  1  0  0  0  0
 26 29  2  0  0  0  0
 27 30  1  0  0  0  0
 30 31  2  0  0  0  0
 31 33  1  0  0  0  0
 32 33  2  0  0  0  0
 32 35  1  0  0  0  0
M  END
>  <Mol_ID> (210)
6910

>  <Formula> (210)
C28H38N4O3

>  <MolWeight> (210)
478.62632

>  <Cat> (210)
S8812

>  <Name> (210)
CM272(CM-272)

>  <Synonyms> (210)
N/A

>  <Target> (210)
DNA Methyltransferase

>  <Form> (210)
Free Base

>  <CAS> (210)
1846570-31-7

>  <URL> (210)
http://www.selleck.cn/products/cm272-cm-272.html

$$$$

csChFnd80/06042113042D

 19 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (211)
6915

>  <Formula> (211)
C16H13N3

>  <MolWeight> (211)
247.29452

>  <Cat> (211)
S8909

>  <Name> (211)
UBCS039

>  <Synonyms> (211)
N/A

>  <Target> (211)
Sirtuin

>  <Form> (211)
Free Base

>  <CAS> (211)
358721-70-7

>  <URL> (211)
http://www.selleck.cn/products/ubcs039.html

$$$$

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>  <Mol_ID> (212)
6975

>  <Formula> (212)
C26H23N5O2

>  <MolWeight> (212)
437.49312

>  <Cat> (212)
S8961

>  <Name> (212)
Alobresib (GS-5829)

>  <Synonyms> (212)
N/A

>  <Target> (212)
Epigenetic Reader Do

>  <Form> (212)
Free Base

>  <CAS> (212)
1637771-14-2

>  <URL> (212)
http://www.selleckchem.com/products/alobresib.html

$$$$

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6976

>  <Formula> (213)
C15H14FN3O2

>  <MolWeight> (213)
287.2889632

>  <Cat> (213)
S8962

>  <Name> (213)
BRD3308

>  <Synonyms> (213)
N/A

>  <Target> (213)
HDAC

>  <Form> (213)
Free Base

>  <CAS> (213)
1550053-02-5

>  <URL> (213)
http://www.selleckchem.com/products/brd3308.html

$$$$

csChFnd80/06042113042D

 22 24  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (214)
7044

>  <Formula> (214)
C17H19N3O2

>  <MolWeight> (214)
297.35166

>  <Cat> (214)
S0184

>  <Name> (214)
XY1

>  <Synonyms> (214)
N/A

>  <Target> (214)
PRMT

>  <Form> (214)
Free Base

>  <CAS> (214)
1624117-53-8

>  <URL> (214)
http://www.selleckchem.com/products/xy1.html

$$$$

csChFnd80/06042113042D

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7079

>  <Formula> (215)
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>  <MolWeight> (215)
450.93902

>  <Cat> (215)
S6722

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>  <Target> (215)
LSD1

>  <Form> (215)
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>  <CAS> (215)
1423715-37-0

>  <URL> (215)
http://www.selleckchem.com/products/seclidemstat.html

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csChFnd80/06042113042D

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M  END
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SMYD

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432529-82-3

>  <URL> (216)
http://www.selleckchem.com/products/bcl-121.html

$$$$

csChFnd80/06042113042D

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C17H18N4O4

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>  <Synonyms> (217)
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>  <Target> (217)
PRMT

>  <Form> (217)
Free Base

>  <CAS> (217)
2040291-27-6

>  <URL> (217)
http://www.selleckchem.com/products/lly-283.html

$$$$

csChFnd80/06042113042D

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7108

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>  <Synonyms> (218)
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Epigenetic Reader Do

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1797406-69-9

>  <URL> (218)
http://www.selleckchem.com/products/mz-1.html

$$$$

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M  END
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7113

>  <Formula> (219)
C20H22ClF3N2O3

>  <MolWeight> (219)
430.8484896

>  <Cat> (219)
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>  <Name> (219)
YF-2

>  <Target> (219)
Histone Acetyltransf

>  <Form> (219)
free base

>  <CAS> (219)
1311423-89-8

>  <URL> (219)
http://www.selleckchem.com/products/yf-2.html

$$$$

csChFnd80/06042113042D

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>  <Mol_ID> (220)
7128

>  <Formula> (220)
C34H31ClN8O5S

>  <MolWeight> (220)
699.17854

>  <Cat> (220)
S0137

>  <Name> (220)
dBET57

>  <Target> (220)
Epigenetic Reader Do

>  <Form> (220)
free base

>  <CAS> (220)
1883863-52-2

>  <URL> (220)
http://www.selleckchem.com/products/dbet57.html

$$$$

csChFnd80/06042113042D

 22 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (221)
7137

>  <Formula> (221)
C17H13ClN4

>  <MolWeight> (221)
308.76492

>  <Cat> (221)
S0201

>  <Name> (221)
Z-JIB-04 (NSC 693627)

>  <Target> (221)
Histone Demethylase

>  <Form> (221)
free base

>  <CAS> (221)
199596-24-2

>  <URL> (221)
http://www.selleckchem.com/products/z-jib-04-nsc-693627.html

$$$$

csChFnd80/06042113042D

 32 34  0  0  0  0  0  0  0  0999 V2000
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7171

>  <Formula> (222)
C22H22F3N3O4

>  <MolWeight> (222)
449.4229896

>  <Cat> (222)
S0709

>  <Name> (222)
Tubastatin A TFA

>  <Target> (222)
HDAC

>  <Form> (222)
trifluoroacetate

>  <CAS> (222)
1239262-52-2

>  <URL> (222)
http://www.selleckchem.com/products/tubastatin-a-tfa.html

$$$$

csChFnd80/06042113042D

 23 24  0  0  0  0  0  0  0  0999 V2000
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   12.1244    3.3124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    4.0124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    5.4124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    6.1124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    5.4124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    6.1124    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  2  7  2  0  0  0  0
  1  8  2  0  0  0  0
  1  9  1  0  0  0  0
 10 11  1  0  0  0  0
 10 13  1  0  0  0  0
 10 12  1  0  0  0  0
  5 10  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
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 21 22  1  0  0  0  0
 17 22  2  0  0  0  0
 15 17  1  0  0  0  0
 20 23  1  0  0  0  0
  9 14  1  0  0  0  0
M  END
>  <Mol_ID> (223)
7192

>  <Formula> (223)
C18H21N3OS

>  <MolWeight> (223)
327.44384

>  <Cat> (223)
S2176

>  <Name> (223)
Tenovin-3

>  <Target> (223)
Sirtuin

>  <Form> (223)
free base

>  <CAS> (223)
1011301-27-1

>  <URL> (223)
http://www.selleckchem.com/products/tenovin-3.html

$$$$

csChFnd80/06042113042D

 25 27  0  0  0  0  0  0  0  0999 V2000
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    2.4207    1.3951    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.6331    2.0951    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.6331    3.4951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    4.1951    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
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    0.0000    1.3976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  1  1  0  0  0  0
  6  7  1  1  0  0  0
  2  8  1  1  0  0  0
  4  9  1  1  0  0  0
  1 10  1  6  0  0  0
  3 11  1  6  0  0  0
  9 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 14 20  1  0  0  0  0
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 22 23  2  0  0  0  0
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M  END
>  <Mol_ID> (224)
7236

>  <Formula> (224)
C16H18O9

>  <MolWeight> (224)
354.30872

>  <Cat> (224)
S3262

>  <Name> (224)
Scopolin

>  <Target> (224)
Sirtuin

>  <Form> (224)
free base

>  <CAS> (224)
531-44-2

>  <URL> (224)
http://www.selleckchem.com/products/scopolin.html

$$$$

csChFnd80/06042113042D

 36 40  0  0  0  0  0  0  0  0999 V2000
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   12.7088    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  2  7  2  0  0  0  0
  1  8  2  0  0  0  0
  1  9  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
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 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
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 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
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 16 20  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 17 21  2  0  0  0  0
 18 23  1  0  0  0  0
 24 25  1  0  0  0  0
 19 24  1  0  0  0  0
 11 22  1  0  0  0  0
  9 10  1  0  0  0  0
 26 27  1  0  0  0  0
  6 26  1  0  0  0  0
 28 29  1  0  0  0  0
  5 28  1  0  0  0  0
 30 31  1  0  0  0  0
  4 30  1  0  0  0  0
 25 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 25  1  0  0  0  0
M  END
>  <Mol_ID> (225)
7306

>  <Formula> (225)
C26H29N5O4S

>  <MolWeight> (225)
507.60456

>  <Cat> (225)
S6880

>  <Name> (225)
SRT-1460

>  <Target> (225)
Sirtuin

>  <Form> (225)
free base

>  <CAS> (225)
925432-73-1

>  <URL> (225)
http://www.selleckchem.com/products/srt-1460.html

$$$$

csChFnd80/06042113042D

 10 11  0  0  0  0  0  0  0  0999 V2000
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
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  9  5  1  0  0  0  0
  9 10  1  0  0  0  0
M  END
>  <Mol_ID> (226)
7308

>  <Formula> (226)
C6H6N4

>  <MolWeight> (226)
134.13864

>  <Cat> (226)
S6886

>  <Name> (226)
1-Aminobenzotriazole

>  <Target> (226)
P450 (e.g. CYP17)

>  <Form> (226)
free base

>  <CAS> (226)
1614-12-6

>  <URL> (226)
http://www.selleckchem.com/products/1-aminobenzotriazole.html

$$$$

csChFnd80/06042113042D

 32 36  0  0  0  0  0  0  0  0999 V2000
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   11.7044    7.0146    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 10 13  1  0  0  0  0
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 27 30  2  0  0  0  0
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M  END
>  <Mol_ID> (227)
7327

>  <Formula> (227)
C25H27N5O2

>  <MolWeight> (227)
429.51418

>  <Cat> (227)
S8574

>  <Name> (227)
BI 894999

>  <Target> (227)
Epigenetic Reader Do

>  <Form> (227)
free base

>  <CAS> (227)
1660117-38-3

>  <URL> (227)
http://www.selleckchem.com/products/bi894999.html

$$$$

csChFnd80/06042113042D

 53 60  0  0  0  0  0  0  0  0999 V2000
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 24 25  1  0  0  0  0
 38 54  1  6  0  0  0
  9 12  2  0  0  0  0
 42 55  1  6  0  0  0
 10 14  1  0  0  0  0
 40 56  1  6  0  0  0
 13 11  1  0  0  0  0
 24 57  1  6  0  0  0
 11 12  1  0  0  0  0
 17 58  1  6  0  0  0
 13 14  1  0  0  0  0
 14 59  1  6  0  0  0
 24 29  1  0  0  0  0
  5 60  1  6  0  0  0
 25 26  1  0  0  0  0
  6 61  1  6  0  0  0
 26 27  1  0  0  0  0
  1 62  1  0  0  0  0
 27 28  1  0  0  0  0
  1 63  1  0  0  0  0
 28 29  1  0  0  0  0
 19 64  1  0  0  0  0
  1  2  1  0  0  0  0
 19 65  1  0  0  0  0
 29 30  1  6  0  0  0
 61 66  1  0  0  0  0
  1  4  1  0  0  0  0
 61 67  2  0  0  0  0
 30 31  1  0  0  0  0
 35 68  1  6  0  0  0
 31 32  1  0  0  0  0
 68 69  1  0  0  0  0
M  END
>  <Mol_ID> (230)
7429

>  <Formula> (230)
C47H76O16

>  <MolWeight> (230)
897.09674

>  <Cat> (230)
S9262

>  <Name> (230)
Raddeanin A

>  <Synonyms> (230)
Raddeanin R3, NSC382873

>  <Target> (230)
HDAC

>  <Form> (230)
Free Base

>  <CAS> (230)
89412-79-3

>  <URL> (230)
https://www.selleckchem.com/products/raddeanin-a.html

$$$$

csChFnd80/06042113042D

 25 27  0  0  0  0  0  0  0  0999 V2000
    0.0000    9.8000    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    5.6000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    7.3870    1.6734    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0248    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8248    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    7.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.2040    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3870    3.9266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8218    5.2574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 22  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  2  0  0  0  0
  2  8  1  0  0  0  0
  2 14  1  0  0  0  0
  3  9  1  0  0  0  0
  3 13  1  0  0  0  0
  4 15  1  0  0  0  0
  4 24  1  0  0  0  0
  7 18  1  0  0  0  0
  7 25  1  0  0  0  0
  8 10  1  0  0  0  0
  9 17  2  0  0  0  0
 10 12  1  0  0  0  0
 10 15  2  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
 11 17  1  0  0  0  0
 13 16  2  0  0  0  0
 14 18  2  0  0  0  0
 14 19  1  0  0  0  0
 15 16  1  0  0  0  0
 17 20  1  0  0  0  0
 18 21  1  0  0  0  0
 19 22  2  0  0  0  0
 21 23  2  0  0  0  0
 22 23  1  0  0  0  0
M  END
>  <Mol_ID> (231)
7497

>  <Formula> (231)
C16H15BrN2O5S

>  <MolWeight> (231)
427.2697

>  <Cat> (231)
S0344

>  <Name> (231)
Y06036

>  <Synonyms> (231)
N/A

>  <Target> (231)
Epigenetic Reader Domain

>  <Form> (231)
Free Base

>  <CAS> (231)
1832671-96-1

>  <URL> (231)
https://www.selleckchem.com/products/y06036.html

$$$$

csChFnd80/06042113042D

 24 27  0  0  0  0  0  0  0  0999 V2000
    4.9064    4.5792    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    6.1174    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9175    4.1908    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3682    3.0054    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.9940    1.6185    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.4605    4.0816    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2064    2.4249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2475    1.3263    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8188    1.6185    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7738    3.7563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3523    4.0816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6064    2.4249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0390    3.7563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.3016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5653    1.3263    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4446    3.0054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8128    3.3016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7536    2.2650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2404    4.6348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1218    2.5614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6085    4.9312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5493    3.8944    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0625    1.5245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0359    6.2642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 10  1  0  0  0  0
  1 13  1  0  0  0  0
  2 15  2  0  0  0  0
  3 22  1  0  0  0  0
  4  9  1  0  0  0  0
  4 11  1  0  0  0  0
  4 14  1  0  0  0  0
  5 15  1  0  0  0  0
  5 16  1  0  0  0  0
  6 13  1  0  0  0  0
  6 16  2  0  0  0  0
  7  8  1  0  0  0  0
  7 10  2  0  0  0  0
  7 12  1  0  0  0  0
  8  9  1  0  0  0  0
 10 11  1  0  0  0  0
 12 13  2  0  0  0  0
 12 15  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  2  0  0  0  0
 20 22  2  0  0  0  0
 20 23  1  0  0  0  0
 21 22  1  0  0  0  0
 21 24  1  0  0  0  0
M  END
>  <Mol_ID> (232)
7544

>  <Formula> (232)
C18H19N3O2S

>  <MolWeight> (232)
341.42736

>  <Cat> (232)
S1027

>  <Name> (232)
FL-411

>  <Synonyms> (232)
BRD4-IN-1

>  <Target> (232)
Epigenetic Reader Domain. Autophagy

>  <Form> (232)
Free Base

>  <CAS> (232)
2118944-88-8

>  <URL> (232)
https://www.selleckchem.com/products/fl-411.html

$$$$

csChFnd80/06042113042D

 25 27  0  0  0  0  0  0  0  0999 V2000
    9.6995    9.8000    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4000    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995   12.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621   11.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747   12.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871   11.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 20  1  0  0  0  0
  2 21  1  0  0  0  0
  3 11  2  0  0  0  0
  4 24  1  0  0  0  0
  5 25  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
  9 11  1  0  0  0  0
  9 12  2  0  0  0  0
 10 11  1  0  0  0  0
 10 13  2  0  0  0  0
 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  2  0  0  0  0
 14 18  1  0  0  0  0
 15 17  2  0  0  0  0
 15 19  1  0  0  0  0
 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
 18 22  2  0  0  0  0
 19 23  2  0  0  0  0
 20 24  2  0  0  0  0
 21 25  2  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
M  END
>  <Mol_ID> (233)
7545

>  <Formula> (233)
C20H16Br2O3

>  <MolWeight> (233)
464.14724

>  <Cat> (233)
S1161

>  <Name> (233)
Histone?Acetyltransferase?Inhibitor?II

>  <Synonyms> (233)
HAT Inhibitor II

>  <Target> (233)
Epigenetic Reader Domain, Histone Acetyltran

>  <Form> (233)
Free Base

>  <CAS> (233)
932749-62-7

>  <URL> (233)
https://www.selleckchem.com/products/histone-acetyltransferase-inhibitor-ii.html

$$$$

csChFnd80/06042113042D

 19 21  0  0  0  0  0  0  0  0999 V2000
    3.6089    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    4.3089    7.7544    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.6555   10.1660    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0862    8.8870    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4763    6.4230    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   12.6300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1326   13.4529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4326   11.2986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2652   12.6300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8326   11.2986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9089    7.7544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6089    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6089    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7417    6.4230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8215    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3965    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8215    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3965    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6089    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 19  1  0  0  0  0
  2 11  1  0  0  0  0
  2 14  1  0  0  0  0
  3  4  1  0  0  0  0
  3 10  2  0  0  0  0
  4 11  1  0  0  0  0
  5 11  2  0  0  0  0
  5 12  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
  9 10  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  2  0  0  0  0
 13 15  2  0  0  0  0
 13 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  2  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (234)
7547

>  <Formula> (234)
C14H14ClN3S

>  <MolWeight> (234)
291.79906

>  <Cat> (234)
S1242

>  <Name> (234)
CPTH2

>  <Synonyms> (234)
N/A

>  <Target> (234)
Histone Acetyltransferase. Apoptosis related

>  <Form> (234)
Free Base

>  <CAS> (234)
357649-93-5

>  <URL> (234)
https://www.selleckchem.com/products/cpth2.html

$$$$

csChFnd80/06042113042D

 29 31  0  0  0  0  0  0  0  0999 V2000
   13.3371    6.3001    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9123    6.3001    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9123    3.5001    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2748    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2126    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.3371    3.5001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3371    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5495    4.2001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1247    4.2001    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   14.5495    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7621    3.5001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7621    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3371    7.7002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4697    8.5231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2045    8.5231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1247    5.6001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0371    9.8545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6371    9.8545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6997    4.2001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4873    3.5001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2748    4.2001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4873    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0624    3.5001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0624    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 15  1  0  0  0  0
  1 18  1  0  0  0  0
  2 18  2  0  0  0  0
  3 29  2  0  0  0  0
  4  7  1  0  0  0  0
 11  5  1  6  0  0  0
  5 21  1  0  0  0  0
  6 24  1  0  0  0  0
  6 26  2  0  0  0  0
  7 29  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 11  1  0  0  0  0
  9 12  1  0  0  0  0
 10 13  1  0  0  0  0
 11 18  1  0  0  0  0
 12 14  1  0  0  0  0
 13 14  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
 19 20  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 22 24  2  0  0  0  0
 23 25  2  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
M  END
>  <Mol_ID> (235)
7550

>  <Formula> (235)
C22H33N3O4

>  <MolWeight> (235)
403.51512

>  <Cat> (235)
S1313

>  <Name> (235)
GSK3117391

>  <Synonyms> (235)
GSK3117391A, HDAC-IN-3

>  <Target> (235)
HDAC

>  <Form> (235)
Free Base

>  <CAS> (235)
1018673-42-1

>  <URL> (235)
https://www.selleckchem.com/products/gsk3117391.html

$$$$

csChFnd80/06042113042D

 12  9  0  0  0  0  0  0  0  0999 V2000
   10.7932    1.4389    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4389    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
    7.0781    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5031    1.4000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    8.2907    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2284    1.4000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.4408    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8657    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0781    1.4000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.6533    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2907    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4408    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  9  3  1  1  0  0  0
  4 11  1  0  0  0  0
  5 11  2  0  0  0  0
  6 12  1  0  0  0  0
  7 12  2  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  9 11  1  0  0  0  0
 10 12  1  0  0  0  0
M  END
>  <Mol_ID> (236)
7553

>  <Formula> (236)
C5H6Na2O5

>  <MolWeight> (236)
192.07768

>  <Cat> (236)
S1325

>  <Name> (236)
L-2-Hydroxyglutaric acid disodium

>  <Synonyms> (236)
(S)-2-Hydroxyglutaric acid disodium, L-2-Hydroxyglutarate disodium, LG

>  <Target> (236)
Histone Demethylase

>  <Form> (236)
Disodium

>  <CAS> (236)
63512-50-5

>  <URL> (236)
https://www.selleckchem.com/products/l-2-hydroxyglutaric-acid-disodium.html

$$$$

csChFnd80/06042113042D

 26 28  0  0  0  0  0  0  0  0999 V2000
   10.1550    5.8533    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.4912    6.2777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7139    4.5246    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.3391    6.9910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4957    7.6777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6999    5.5748    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.3784    4.0980    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5299    3.3748    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.1690    8.1185    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.7168    8.3748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9106    6.2687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3733    2.7002    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.7000    2.2594    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.9298    3.3748    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9260    7.6687    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.7168    9.7748    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2376    1.8816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1238    0.9251    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9608    2.4558    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.8251    1.6372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5483    2.2115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4125    1.3929    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.1357    1.9671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5536    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.1485    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9946    3.3600    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  1  1  1  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  5  9  1  0  0  0  0
  6 11  2  0  0  0  0
  7 12  1  0  0  0  0
  8 13  1  0  0  0  0
  8 14  1  6  0  0  0
 10 15  2  0  0  0  0
 10 16  1  0  0  0  0
 11 15  1  0  0  0  0
 12 17  1  1  0  0  0
 12 13  1  0  0  0  0
 13 18  1  6  0  0  0
 17 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  6  0  0  0
 23 25  1  0  0  0  0
 23 26  2  0  0  0  0
M  END
>  <Mol_ID> (237)
7708

>  <Formula> (237)
C14H20N6O5S

>  <MolWeight> (237)
384.4108

>  <Cat> (237)
S7868

>  <Name> (237)
S-Adenosyl-L-homocysteine (SAH)

>  <Synonyms> (237)
S-Adenosylhomocysteine, AdoHcy, Formycinylhomocysteine

>  <Target> (237)
Histone Methyltransferase

>  <Form> (237)
Free Base

>  <CAS> (237)
979-92-0

>  <URL> (237)
https://www.selleckchem.com/products/s-adenosyl-l-homocysteine.html

$$$$

csChFnd80/06042113042D

 24 26  0  0  0  0  0  0  0  0999 V2000
    4.8550    3.4539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0987    4.1719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3103    3.4724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3103    2.0942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1007    1.3959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8724    2.1050    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0987    5.5914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2955    6.2824    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8593    6.3070    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.5531    1.3767    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5531    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7967    2.0947    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6483    1.3982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4333    2.0997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2116    1.3944    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4293    3.4854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6484    4.1505    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8593    7.7012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0016    1.3990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4124    1.3990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7124    0.1866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  1  6  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  2  7  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
  4 10  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 14 19  2  0  0  0  0
 13 14  1  0  0  0  0
  6 13  1  0  0  0  0
  1 20  2  0  0  0  0
  9 21  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 22 24  1  0  0  0  0
 12 22  1  0  0  0  0
M  END
>  <Mol_ID> (238)
7753

>  <Formula> (238)
C18H19N3O3

>  <MolWeight> (238)
325.36176

>  <Cat> (238)
S9685

>  <Name> (238)
GSK620

>  <Synonyms> (238)
N/A

>  <Target> (238)
Epigenetic Reader Domain

>  <Form> (238)
Free Base

>  <CAS> (238)
2088410-46-0

>  <URL> (238)
http://www.selleckchem.com/products/gsk620.html

$$$$

csChFnd80/06042113042D

 39 44  0  0  0  0  0  0  0  0999 V2000
    3.4240    6.7538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4240    5.3538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6364    4.6538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8488    5.3538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8488    6.7538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6364    7.4538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1803    4.9211    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.0032    6.0538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1803    7.1864    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.6114    8.5132    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.9809    8.8043    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4135   10.1358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4767   11.1762    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.1073   10.8851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6747    9.5536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9078   12.5031    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2601   12.8654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2157    4.6562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9368    5.2256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.0694    3.2639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1062    2.3303    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6467    6.5903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3984    6.0538    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.0984    4.8413    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.4984    4.8413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1984    6.0538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4984    7.2662    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0984    7.2662    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4008    3.6331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.4008    1.2082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1008    2.4207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1959    3.6331    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9057    2.4207    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    7.3032    0.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9  5  1  0  0  0  0
 10  9  1  1  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 10  1  0  0  0  0
 13 16  1  6  0  0  0
 16 17  1  0  0  0  0
  2 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 18  2  0  0  0  0
 22 23  1  0  0  0  0
 19 24  1  0  0  0  0
 25  8  1  6  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 25  1  0  0  0  0
 26 31  1  0  0  0  0
 31 32  2  0  0  0  0
 32 33  1  0  0  0  0
 33 34  2  0  0  0  0
 34 35  1  0  0  0  0
 35 36  2  0  0  0  0
 36 31  1  0  0  0  0
 27 37  2  0  0  0  0
 33 38  1  0  0  0  0
 34 39  1  0  0  0  0
M  END
>  <Mol_ID> (239)
7762

>  <Formula> (239)
C30H32F2N4O3

>  <MolWeight> (239)
534.5968864

>  <Cat> (239)
S9667

>  <Name> (239)
CCS-1477 (CBP-IN-1)

>  <Synonyms> (239)
CBP-IN-1, CBP/p300-IN-4

>  <Target> (239)
Epigenetic Reader Domain

>  <Form> (239)
Free Base

>  <CAS> (239)
2222941-37-7

>  <URL> (239)
http://www.selleckchem.com/products/ccs-1477-cbp-in-1-.html

$$$$

csChFnd80/06042113042D

 40 46  0  0  0  0  0  0  0  0999 V2000
    0.0000   11.9004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4249   11.9004    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124   12.6004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373   12.6004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497   11.9004    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   12.6004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6373   14.0004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
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Syk

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2254693-15-5

>  <URL> (240)
http://www.selleckchem.com/products/srx3207.html

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csChFnd80/06042113042D

 30 32  0  0  0  0  0  0  0  0999 V2000
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C23H27FN2O4

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iBET-BD2

>  <Target> (241)
Epigenetic Reader Domain

>  <Form> (241)
Free Base

>  <CAS> (241)
2474876-09-8

>  <URL> (241)
http://www.selleckchem.com/products/gsk046.html

$$$$

csChFnd80/06042113042D

 24 26  0  0  0  0  0  0  0  0999 V2000
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HDAC

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>  <CAS> (242)
1375466-18-4

>  <URL> (242)
http://www.selleckchem.com/products/acy-775.html

$$$$

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7906

>  <Formula> (243)
C20H16ClN3O2

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>  <Target> (243)
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1380087-89-7

>  <URL> (243)
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    8.5821    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2821    4.3876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9821    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3697    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9449    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7324    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7324    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9449    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5200    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5200    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5200    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7324    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9449    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5200    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7324    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2685    4.2484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2685    1.3514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1573    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0952    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.5291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.0709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  2  0  0  0  0
  1  4  2  0  0  0  0
  1 17  1  0  0  0  0
  1 25  1  0  0  0  0
  2 10  1  0  0  0  0
  2 11  1  0  0  0  0
  5 21  2  0  0  0  0
  6 19  1  0  0  0  0
  6 21  1  0  0  0  0
  6 24  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 10  1  0  0  0  0
  8  9  1  0  0  0  0
 11 12  2  0  0  0  0
 11 14  1  0  0  0  0
 12 13  1  0  0  0  0
 12 15  1  0  0  0  0
 13 16  1  0  0  0  0
 13 19  2  0  0  0  0
 14 18  2  0  0  0  0
 15 17  2  0  0  0  0
 16 20  1  0  0  0  0
 16 22  2  0  0  0  0
 17 18  1  0  0  0  0
 20 21  1  0  0  0  0
 20 23  2  0  0  0  0
 22 26  1  0  0  0  0
 23 27  1  0  0  0  0
 26 27  2  0  0  0  0
M  END
>  <Mol_ID> (244)
7941

>  <Formula> (244)
C21H21NO4S

>  <MolWeight> (244)
383.46074

>  <Cat> (244)
S3573

>  <Name> (244)
CC-90010

>  <Synonyms> (244)
N/A

>  <Target> (244)
Epigenetic Reader Domain

>  <Form> (244)
Free Base

>  <CAS> (244)
1706738-98-8

>  <URL> (244)
http://www.selleckchem.com/products/cc-90010.html

$$$$

csChFnd80/06042113042D

 12 12  0  0  0  0  0  0  0  0999 V2000
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    3.6373    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  9  1  0  0  0  0
  2  9  2  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  4  6  1  0  0  0  0
  5  7  2  0  0  0  0
  5  8  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
  8 11  2  0  0  0  0
 10 12  2  0  0  0  0
 11 12  1  0  0  0  0
M  END
>  <Mol_ID> (245)
7944

>  <Formula> (245)
C10H12O2

>  <MolWeight> (245)
164.20108

>  <Cat> (245)
S3592

>  <Name> (245)
4-Phenylbutyric acid (4-PBA)

>  <Synonyms> (245)
Benzenebutyric acid

>  <Target> (245)
HDAC

>  <Form> (245)
Free Base

>  <CAS> (245)
1821-12-1

>  <URL> (245)
http://www.selleckchem.com/products/4-phenylbutyric-acid-4-pba-.html

$$$$
