Y-27632 2HCL.cdx
csChFnd80/10281914122D

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C14H23Cl2N3O

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Y-27632 2HCl

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N/A

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ROCK

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Dihydrochloride

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129830-38-2

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http://www.selleckchem.com/products/Y-27632.html

$$$$
untitled.cdx
csChFnd80/10281914122D

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>  <Mol_ID> (2)
36

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C32H29N5O2

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Enzastaurin (LY317615)

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N/A 

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PKC 

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Free Base

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170364-57-5

>  <URL> (2)
http://www.selleckchem.com/products/Enzastaurin.html

$$$$
untitled.cdx
csChFnd80/10281914122D

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>  <Mol_ID> (3)
42

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C22H16N4O3

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TGF-beta/Smad

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Free Base

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301836-41-9

>  <URL> (3)
http://www.selleckchem.com/products/SB-431542.html

$$$$
Thiazovivin.cdx
csChFnd80/10281914122D

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>  <Mol_ID> (4)
285

>  <Formula> (4)
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ROCK

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1226056-71-8

>  <URL> (4)
http://www.selleckchem.com/products/Thiazovivin.html

$$$$
GSK429286A.cdx
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>  <Mol_ID> (5)
295

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GSK429286A

>  <Synonyms> (5)
N/A

>  <Target> (5)
ROCK 

>  <Form> (5)
Free Base

>  <CAS> (5)
864082-47-3

>  <URL> (5)
http://www.selleckchem.com/products/GSK429286A.html

$$$$
SB525334.cdx
csChFnd80/10281914122D

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>  <Mol_ID> (6)
297

>  <Formula> (6)
C21H21N5

>  <MolWeight> (6)
343.42494

>  <Cat> (6)
S1476

>  <Name> (6)
SB 525334

>  <Synonyms> (6)
N/A

>  <Target> (6)
TGF-beta/Smad

>  <Form> (6)
Free Base

>  <CAS> (6)
356559-20-1

>  <URL> (6)
http://www.selleckchem.com/products/SB-525334.html

$$$$
Fasudil HCl.cdx
csChFnd80/10281914122D

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M  END
>  <Mol_ID> (7)
352

>  <Formula> (7)
C14H18ClN3O2S

>  <MolWeight> (7)
327.82962

>  <Cat> (7)
S1573

>  <Name> (7)
Fasudil HCl (HA-1077)

>  <Synonyms> (7)
AT-877 

>  <Target> (7)
ROCK

>  <Form> (7)
Hydrochloride

>  <CAS> (7)
105628-07-7

>  <URL> (7)
http://www.selleckchem.com/products/Fasudil-HCl(HA-1077).html

$$$$
Quercetin.cdx
csChFnd80/10281914122D

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>  <Mol_ID> (8)
532

>  <Formula> (8)
C15H10O7

>  <MolWeight> (8)
302.2357

>  <Cat> (8)
S2391

>  <Name> (8)
Quercetin (Sophoretin)

>  <Synonyms> (8)
Meletin, Quercetine

>  <Target> (8)
PI3K, PKC, Src, Sirtuin

>  <Form> (8)
Free Base

>  <CAS> (8)
117-39-5

>  <URL> (8)
http://www.selleckchem.com/products/Quercetin(Sophoretin).html

$$$$
Daphnetin.cdx
csChFnd80/10281914122D

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>  <Mol_ID> (9)
566

>  <Formula> (9)
C9H6O4

>  <MolWeight> (9)
178.14154

>  <Cat> (9)
S2554

>  <Name> (9)
Daphnetin

>  <Synonyms> (9)
N/A 

>  <Target> (9)
DNA/RNA Synthesis

>  <Form> (9)
Free Base

>  <CAS> (9)
486-35-1

>  <URL> (9)
http://www.selleckchem.com/products/Daphnetin.html

$$$$
Hesperetin.cdx
csChFnd80/10281914122D

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M  END
>  <Mol_ID> (10)
638

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C16H14O6

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>  <Name> (10)
Hesperetin

>  <Synonyms> (10)
N/A

>  <Target> (10)
Histamine Receptor

>  <Form> (10)
Free Base

>  <CAS> (10)
520-33-2

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

$$$$
Myricitrin.cdx
csChFnd80/10281914122D

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>  <Mol_ID> (11)
653

>  <Formula> (11)
C21H20O12

>  <MolWeight> (11)
464.3763

>  <Cat> (11)
S2327

>  <Name> (11)
Myricitrin (Myricitrine)

>  <Synonyms> (11)
Myricitrine, Myricitroside, Myricetol 3-rhamnoside, Myricetin 3-O-rhamnoside 

>  <Target> (11)
PKC

>  <Form> (11)
Free Base

>  <CAS> (11)
17912-87-7

>  <URL> (11)
http://www.selleckchem.com/products/Myricitrin(Myricitrine).html

$$$$

csChFnd80/10281914122D

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>  <Mol_ID> (12)
709

>  <Formula> (12)
C22H30Cl2N4O6

>  <MolWeight> (12)
517.4028

>  <Cat> (12)
S2485

>  <Name> (12)
Mitoxantrone 2HCl

>  <Synonyms> (12)
NSC-301739

>  <Target> (12)
Topoisomerase

>  <Form> (12)
Dihydrochloride

>  <CAS> (12)
70476-82-3

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

$$$$
LY2157299.cdx
csChFnd80/10281914122D

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>  <Mol_ID> (13)
778

>  <Formula> (13)
C22H19N5O

>  <MolWeight> (13)
369.41916

>  <Cat> (13)
S2230

>  <Name> (13)
Galunisertib (LY2157299)

>  <Synonyms> (13)
N/A 

>  <Target> (13)
TGF-beta/Smad

>  <Form> (13)
Free Base

>  <CAS> (13)
700874-72-2

>  <URL> (13)
http://www.selleckchem.com/products/ly2157299.html

$$$$
GW788388(1).cdx
csChFnd80/10281914122D

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>  <Mol_ID> (14)
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694433-59-5

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http://www.selleckchem.com/products/sb-505124.html

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>  <URL> (16)
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53179-13-8

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>  <Mol_ID> (19)
1764

>  <Formula> (19)
C48H78O19

>  <MolWeight> (19)
959.12152

>  <Cat> (19)
S3616

>  <Name> (19)
Asiaticoside

>  <Synonyms> (19)
Ba 2742, BRN0078195, CCRIS8995, NSC166062, Emdecassol,Madecassol

>  <Target> (19)
Others

>  <Form> (19)
free base

>  <CAS> (19)
16830-15-2

>  <URL> (19)
http://www.selleckchem.com/products/asiaticoside.html

$$$$
S3661 2-Methoxy-1,4-naphthoquinone.cdx
csChFnd80/10281914122D

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>  <Mol_ID> (20)
1789

>  <Formula> (20)
C11H8O3

>  <MolWeight> (20)
188.17942

>  <Cat> (20)
S3661

>  <Name> (20)
2-Methoxy-1,4-naphthoquinone

>  <Synonyms> (20)
N/A

>  <Target> (20)
PKC

>  <Form> (20)
free base

>  <CAS> (20)
2348-82-5

>  <URL> (20)
http://www.selleckchem.com/products/2-methoxy-1-4-naphthoquinone.html

$$$$
S3819 Decursinol angelate.cdx
csChFnd80/10281914122D

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>  <Mol_ID> (21)
1895

>  <Formula> (21)
C19H20O5

>  <MolWeight> (21)
328.3591

>  <Cat> (21)
S3819

>  <Name> (21)
Decursinol angelate

>  <Synonyms> (21)
N/A

>  <Target> (21)
PKC

>  <Form> (21)
free base

>  <CAS> (21)
130848-06-5

>  <URL> (21)
http://www.selleckchem.com/products/decursinol-angelate.html

$$$$
LY2109761.cdx
csChFnd80/10281914122D

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>  <Mol_ID> (22)
2428

>  <Formula> (22)
C26H27N5O2

>  <MolWeight> (22)
441.52488

>  <Cat> (22)
S2704

>  <Name> (22)
LY2109761

>  <Synonyms> (22)
N/A

>  <Target> (22)
TGF-beta/Smad

>  <Form> (22)
Free Base

>  <CAS> (22)
700874-71-1 

>  <URL> (22)
http://www.selleckchem.com/products/ly2109761.html

$$$$
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396129-53-6

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http://www.selleckchem.com/products/ly364947.html

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ROCK

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1342278-01-6

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446859-33-2

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$$$$
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Ro 31-8220 Mesylate

>  <Synonyms> (26)
Bisindolylmaleimide IX Mesylate

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PKC

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>  <CAS> (26)
138489-18-6

>  <URL> (26)
http://www.selleckchem.com/products/ro-31-8220-mesylate.html

$$$$
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M  END
>  <Mol_ID> (27)
2545

>  <Formula> (27)
C24H27Cl2N5O

>  <MolWeight> (27)
472.41008

>  <Cat> (27)
S7306

>  <Name> (27)
Dorsomorphin (Compound C) 2HCl

>  <Synonyms> (27)
BML-275,Compound C

>  <Target> (27)
AMPK

>  <Form> (27)
Dihydrochloride

>  <CAS> (27)
1219168-18-9

>  <URL> (27)
http://www.selleckchem.com/products/dorsomorphin-2hcl.html

$$$$
LM-3151 K 02288.cdx
csChFnd80/10281914122D

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M  END
>  <Mol_ID> (28)
2649

>  <Formula> (28)
C20H20N2O4

>  <MolWeight> (28)
352.3838

>  <Cat> (28)
S7359

>  <Name> (28)
K02288

>  <Synonyms> (28)
N/A

>  <Target> (28)
TGF-beta/Smad

>  <Form> (28)
Free Base

>  <CAS> (28)
1431985-92-0

>  <URL> (28)
http://www.selleckchem.com/products/k02288.html

$$$$
LDN193189 HCl.cdx
csChFnd80/10281914122D

 32 36  0  0  0  0  0  0  0  0999 V2000
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 12  7  1  0  0  0  0
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 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 31 27  1  0  0  0  0
M  END
>  <Mol_ID> (29)
2670

>  <Formula> (29)
C25H23ClN6

>  <MolWeight> (29)
442.94332

>  <Cat> (29)
S7507

>  <Name> (29)
LDN193189 HCl

>  <Synonyms> (29)
N/A

>  <Target> (29)
TGF-beta/Smad

>  <Form> (29)
Hydrochloride

>  <CAS> (29)
1062368-62-0

>  <URL> (29)
http://www.selleckchem.com/products/ldn-193189-HCl.html

$$$$
ML347.cdx
csChFnd80/10281914122D

 27 31  0  0  0  0  0  0  0  0999 V2000
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  1 10  1  0  0  0  0
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 11 12  2  0  0  0  0
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M  END
>  <Mol_ID> (30)
2684

>  <Formula> (30)
C22H16N4O

>  <MolWeight> (30)
352.38864

>  <Cat> (30)
S7148

>  <Name> (30)
ML347

>  <Synonyms> (30)
N/A

>  <Target> (30)
TGF-beta/Smad

>  <Form> (30)
Free Base

>  <CAS> (30)
1062368-49-3

>  <URL> (30)
http://www.selleckchem.com/products/ml347.html

$$$$
K-Ras(G12C) inhibitor 6.cdx
csChFnd80/10281914122D

 25 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (31)
2687

>  <Formula> (31)
C17H22Cl2N2O3S

>  <MolWeight> (31)
405.33918

>  <Cat> (31)
S7333

>  <Name> (31)
K-Ras(G12C) inhibitor 6

>  <Synonyms> (31)
N/A

>  <Target> (31)
Rho

>  <Form> (31)
Free Base

>  <CAS> (31)
No

>  <URL> (31)
http://www.selleckchem.com/products/k-ras-g12c-inhibitor-6.html

$$$$
DMH1.cdx
csChFnd80/10281914122D

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1206711-16-1

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>  <Synonyms> (33)
BMP Inhibitor III

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TGF-beta/Smad

>  <Form> (33)
Free Base

>  <CAS> (33)
1432597-26-6

>  <URL> (33)
http://www.selleckchem.com/products/ldn-212854.html

$$$$
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K-Ras(G12C) inhibitor 9

>  <Synonyms> (34)
N/A

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Rho

>  <Form> (34)
Free Base

>  <CAS> (34)
1469337-91-4

>  <URL> (34)
http://www.selleckchem.com/products/k-ras-g12c-inhibitor9.html

$$$$
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PKC

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136194-77-9

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$$$$
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>  <Mol_ID> (36)
2780

>  <Formula> (36)
C22H31ClF3N3O4S3

>  <MolWeight> (36)
590.1424496

>  <Cat> (36)
S7330

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6H05

>  <Synonyms> (36)
N/A

>  <Target> (36)
Rho

>  <Form> (36)
Free Base

>  <CAS> (36)
No

>  <URL> (36)
http://www.selleckchem.com/products/6h05.html

$$$$
K-Ras(G12C) inhibitor 12.cdx
csChFnd80/10281914122D

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M  END
>  <Mol_ID> (37)
2794

>  <Formula> (37)
C15H17ClIN3O3

>  <MolWeight> (37)
449.67125

>  <Cat> (37)
S7331

>  <Name> (37)
K-Ras(G12C) inhibitor 12

>  <Synonyms> (37)
N/A

>  <Target> (37)
Rho

>  <Form> (37)
Free Base

>  <CAS> (37)
1469337-95-8

>  <URL> (37)
http://www.selleckchem.com/products/k-ras-g12c-inhibitor-12.html

$$$$
EW-7197.cdx
csChFnd80/10281914122D

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>  <Mol_ID> (38)
2812

>  <Formula> (38)
C22H18FN7

>  <MolWeight> (38)
399.4236232

>  <Cat> (38)
S7530

>  <Name> (38)
EW-7197

>  <Synonyms> (38)
N/A

>  <Target> (38)
TGF-beta/Smad

>  <Form> (38)
Free Base

>  <CAS> (38)
1352608-82-2

>  <URL> (38)
http://www.selleckchem.com/products/ew-7197.html

$$$$
Kartogenin.cdx
csChFnd80/10281914122D

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>  <Mol_ID> (39)
2813

>  <Formula> (39)
C20H15NO3

>  <MolWeight> (39)
317.338

>  <Cat> (39)
S7658

>  <Name> (39)
Kartogenin

>  <Synonyms> (39)
N/A

>  <Target> (39)
TGF-beta/Smad

>  <Form> (39)
Free Base

>  <CAS> (39)
4727-31-5

>  <URL> (39)
http://www.selleckchem.com/products/kartogenin.html

$$$$
GF 109203X(G 6850).cdx
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1056901-62-2

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162520-00-5

>  <URL> (42)
http://www.selleckchem.com/products/salirasib.html

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>  <Mol_ID> (45)
2927

>  <Formula> (45)
C25H29N3O3

>  <MolWeight> (45)
419.51606

>  <Cat> (45)
S7627

>  <Name> (45)
LDN-214117

>  <Synonyms> (45)
N/A

>  <Target> (45)
TGF-beta/Smad

>  <Form> (45)
Free Base

>  <CAS> (45)
1627503-67-6

>  <URL> (45)
http://www.selleckchem.com/products/ldn-214117.html

$$$$
Ripasudil (K-115) hydrochloride dihydrate.cdx
csChFnd80/10281914122D

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M  END
>  <Mol_ID> (46)
3074

>  <Formula> (46)
C15H23ClFN3O4S

>  <MolWeight> (46)
395.8772232

>  <Cat> (46)
S7995

>  <Name> (46)
Ripasudil (K-115)

>  <Synonyms> (46)
N/A

>  <Target> (46)
ROCK

>  <Form> (46)
Hydrochloride dihydrate

>  <CAS> (46)
887375-67-9

>  <URL> (46)
http://www.selleckchem.com/products/ripasudil-k-115.html

$$$$
KD025 (SLx-2119).cdx
csChFnd80/10281914122D

 34 38  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (47)
3085

>  <Formula> (47)
C26H24N6O2

>  <MolWeight> (47)
452.50776

>  <Cat> (47)
S7936

>  <Name> (47)
KD025 (SLx-2119)

>  <Synonyms> (47)
N/A

>  <Target> (47)
ROCK

>  <Form> (47)
Free Base

>  <CAS> (47)
911417-87-3

>  <URL> (47)
http://www.selleckchem.com/products/kd025-(slx-2119).html

$$$$
Halofuginone.cdx
csChFnd80/10281914122D

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M  END
>  <Mol_ID> (48)
3123

>  <Formula> (48)
C16H17BrClN3O3

>  <MolWeight> (48)
414.68148

>  <Cat> (48)
S8144

>  <Name> (48)
Halofuginone

>  <Synonyms> (48)
N/A

>  <Target> (48)
Others

>  <Form> (48)
Free Base

>  <CAS> (48)
55837-20-2

>  <URL> (48)
http://www.selleckchem.com/products/halofuginone.html

$$$$
Kobe0065.cdx
csChFnd80/10281914122D

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>  <Mol_ID> (49)
3185

>  <Formula> (49)
C15H11ClF3N5O4S

>  <MolWeight> (49)
449.7921496

>  <Cat> (49)
S8303

>  <Name> (49)
Kobe0065

>  <Synonyms> (49)
N/A

>  <Target> (49)
Rho

>  <Form> (49)
Free Base

>  <CAS> (49)
436133-68-5

>  <URL> (49)
http://www.selleckchem.com/products/kobe0065.html

$$$$
LY333531.cdx
csChFnd80/10281914122D

 36 40  0  0  0  0  0  0  0  0999 V2000
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    6.5892    7.9998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0057    9.3279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8628   10.1448    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.7155    9.3301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3916    9.7856    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3332    9.7725    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    7.3439    0.7079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7152    0.9900    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.7052    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.5852    2.5053    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
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M  END
>  <Mol_ID> (50)
3223

>  <Formula> (50)
C28H29ClN4O3

>  <MolWeight> (50)
505.00786

>  <Cat> (50)
S7663

>  <Name> (50)
LY333531 HCl

>  <Synonyms> (50)
Ruboxistaurin

>  <Target> (50)
PKC

>  <Form> (50)
hydrochloride

>  <CAS> (50)
169939-93-9

>  <URL> (50)
http://www.selleckchem.com/products/ly333531.html

$$$$
SIS3.cdx
csChFnd80/10281914122D

 35 38  0  0  0  0  0  0  0  0999 V2000
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    6.6792    1.2517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0792    1.2517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7792    2.4641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0792    3.6765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.2377    3.0644    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
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M  END
>  <Mol_ID> (51)
3227

>  <Formula> (51)
C28H28ClN3O3

>  <MolWeight> (51)
489.99322

>  <Cat> (51)
S7959

>  <Name> (51)
SIS3 HCl

>  <Synonyms> (51)
N/A

>  <Target> (51)
TGF-beta/Smad

>  <Form> (51)
hydrochloride

>  <CAS> (51)
521984-48-5

>  <URL> (51)
http://www.selleckchem.com/products/sis3.html

$$$$
Alantolactone.cdx
csChFnd80/10281914122D

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  1  2  1  0  0  0  0
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  4  5  1  0  0  0  0
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  6  1  1  0  0  0  0
  4  7  2  0  0  0  0
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 10  5  1  0  0  0  0
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  8 19  1  6  0  0  0
M  END
>  <Mol_ID> (52)
3266

>  <Formula> (52)
C15H20O2

>  <MolWeight> (52)
232.3181

>  <Cat> (52)
S8318

>  <Name> (52)
Alantolactone

>  <Synonyms> (52)
helenin, helenine, Eupatal

>  <Target> (52)
Others

>  <Form> (52)
Free Base

>  <CAS> (52)
546-43-0

>  <URL> (52)
http://www.selleckchem.com/products/alantolactone.html

$$$$
GSK269962.cdx
csChFnd80/10281914122D

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 34 29  1  0  0  0  0
 32 35  1  0  0  0  0
 35 36  1  0  0  0  0
 33 37  1  0  0  0  0
 37 38  2  0  0  0  0
 38 39  1  0  0  0  0
 39 40  1  0  0  0  0
 40 41  2  0  0  0  0
 41 37  1  0  0  0  0
 41 42  1  0  0  0  0
M  END
>  <Mol_ID> (53)
3278

>  <Formula> (53)
C29H31ClN8O5

>  <MolWeight> (53)
607.06004

>  <Cat> (53)
S7687

>  <Name> (53)
GSK269962 HCl

>  <Synonyms> (53)
GSK 269962, GSK-269962, GSK269962A, GSK 269962A, GSK-269962A, GSK269962B

>  <Target> (53)
ROCK

>  <Form> (53)
hydrochloride

>  <CAS> (53)
850664-21-0(free base)

>  <URL> (53)
http://www.selleckchem.com/products/gsk269962.html

$$$$
Y-39983 HCl.cdx
csChFnd80/10281914122D

 24 24  0  0  0  0  0  0  0  0999 V2000
    9.6794    5.6000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.6794    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8919    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1043    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1043    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8919    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6390    3.2632    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.2085    1.9843    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6008    2.1306    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3168    3.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.5292    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5292    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7416    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7416    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9541    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1665    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1665    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9541    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3789    1.4000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   19.3789    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   20.5914    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.5914    0.7000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7222   28.4575    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   28.4575    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
  2  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9  3  1  0  0  0  0
  4 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 11 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
 17 18  2  0  0  0  0
 18 13  1  0  0  0  0
 16 19  1  0  0  0  0
 19 20  1  6  0  0  0
 19 21  1  0  0  0  0
 19 22  1  1  0  0  0
M  END
>  <Mol_ID> (54)
3304

>  <Formula> (54)
C16H18Cl2N4O

>  <MolWeight> (54)
353.24632

>  <Cat> (54)
S7935

>  <Name> (54)
Y-39983 HCl

>  <Synonyms> (54)
Y-33075 HCl

>  <Target> (54)
ROCK

>  <Form> (54)
dihydrochloride

>  <CAS> (54)
173897-44-4

>  <URL> (54)
http://www.selleckchem.com/products/y-39983-hcl.html

$$$$
ZINC00881524 (ROCK inhibitor).cdx
csChFnd80/10281914122D

 27 30  0  0  0  0  0  0  0  0999 V2000
   11.4619    9.3686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4619    7.9686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6743    7.2686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8868    7.9686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8868    9.3686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6743   10.0686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2495    7.2686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2495    5.8686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4619    5.1686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6743    5.8686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8972    7.6310    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.1347    6.4569    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0157    5.3689    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    6.7366    6.3836    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1010    5.1362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8635    3.9620    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7029    5.0629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0673    3.8155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6693    3.7422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0337    2.4948    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7962    1.3207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1942    1.3940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8298    2.6414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6356    2.4215    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1606    0.0733    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7625    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.1741    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
  2  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  3  1  0  0  0  0
  7 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13  8  1  0  0  0  0
 12 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 15 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  2  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 18  1  0  0  0  0
 20 24  1  0  0  0  0
 21 25  1  0  0  0  0
 25 26  1  0  0  0  0
 24 27  1  0  0  0  0
M  END
>  <Mol_ID> (55)
3308

>  <Formula> (55)
C21H20N2O3S

>  <MolWeight> (55)
380.4601

>  <Cat> (55)
S8448

>  <Name> (55)
ZINC00881524 (ROCK inhibitor)

>  <Synonyms> (55)
N/A

>  <Target> (55)
ROCK

>  <Form> (55)
Free Base

>  <CAS> (55)
557782-81-7

>  <URL> (55)
http://www.selleckchem.com/products/zinc00881524-rock-inhibitor.html

$$$$
Hydroxyfasudil (HA-1100).cdx
csChFnd80/10281914122D

 23 23  0  0  0  0  0  0  0  0999 V2000
    2.8000    7.2586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2000    7.2586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9000    8.4710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2000    9.6835    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8000    9.6835    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1000    8.4710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    8.4710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    7.2586    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    6.0462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1000    6.0462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    9.6835    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9000    6.0462    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.6876    5.3462    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1124    6.7462    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8114    3.6770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.9483    3.9121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9961    4.9384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1777    0.3646    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.7298    0.0000    0.0000 R   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  2  0  0  0  0
  4  5  2  0  0  0  0
  6  1  2  0  0  0  0
  6  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  1  1  0  0  0  0
  7 11  2  0  0  0  0
  2 12  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  2  0  0  0  0
 12 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 15  1  0  0  0  0
  1  2  1  0  0  0  0
  5  6  1  0  0  0  0
  4  3  1  0  0  0  0
A   23
xH2O
M  END
>  <Mol_ID> (56)
3363

>  <Formula> (56)
C14H18ClN3O3RS

>  <MolWeight> (56)
343.82902

>  <Cat> (56)
S8208

>  <Name> (56)
Hydroxyfasudil (HA-1100)HCl

>  <Synonyms> (56)
N/A

>  <Target> (56)
ROCK

>  <Form> (56)
hydrochloride

>  <CAS> (56)
155558-32-0 (HCl salt)

>  <URL> (56)
http://www.selleckchem.com/products/hydroxyfasudil-ha-1100.html

$$$$
GSK180736A.cdx
csChFnd80/10281914122D

 27 30  0  0  0  0  0  0  0  0999 V2000
    2.1544    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1544    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3668    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5792    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5792    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3668    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8229    2.5326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8229    0.2674    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.7917    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0041    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2166    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.8539    4.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0041    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7917    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5792    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.7917    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3668    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
  1  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9  2  1  0  0  0  0
  5 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  2  0  0  0  0
 12 14  2  0  0  0  0
 14 15  1  0  0  0  0
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 18 12  1  0  0  0  0
 18 19  1  0  0  0  0
 14 20  1  0  0  0  0
 16 21  2  0  0  0  0
 19 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 19  1  0  0  0  0
 24 27  1  0  0  0  0
M  END
>  <Mol_ID> (57)
3381

>  <Formula> (57)
C19H16FN5O2

>  <MolWeight> (57)
365.3610432

>  <Cat> (57)
S8489

>  <Name> (57)
GSK180736A

>  <Synonyms> (57)
N/A

>  <Target> (57)
ROCK

>  <Form> (57)
Free Base

>  <CAS> (57)
817194-38-0

>  <URL> (57)
http://www.selleckchem.com/products/gsk180736a.html

$$$$
ARS-853.cdx
csChFnd80/10281914122D

 30 33  0  0  0  0  0  0  0  0999 V2000
    2.4249    5.1899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    3.7899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    3.0899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.1244    3.7899    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    5.1899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    5.8899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    3.0899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6991    1.7377    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0514    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.6891    3.4523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (58)
3397

>  <Formula> (58)
C22H29ClN4O3

>  <MolWeight> (58)
432.94366

>  <Cat> (58)
S8156

>  <Name> (58)
ARS-853 (ARS853)

>  <Synonyms> (58)
N/A

>  <Target> (58)
K-Ras(G12C)

>  <Form> (58)
free base

>  <CAS> (58)
1629268-00-3

>  <URL> (58)
http://www.selleckchem.com/products/ars-853.html

$$$$

csChFnd80/10281914122D

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M  END
>  <Mol_ID> (59)
4283

>  <Formula> (59)
C20H28O5

>  <MolWeight> (59)
348.43332

>  <Cat> (59)
S9101

>  <Name> (59)
Ingenol

>  <Form> (59)
free base

>  <CAS> (59)
30220-46-3

$$$$

csChFnd80/10281914122D

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>  <Mol_ID> (60)
4944

>  <Formula> (60)
C24H29N5O3

>  <MolWeight> (60)
435.51876

>  <Cat> (60)
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>  <Name> (60)
LY 3200882 

>  <Synonyms> (60)
N/A

>  <Target> (60)
TGF-beta/Smad

>  <Form> (60)
Free Base

>  <CAS> (60)
1898283-02-7

>  <URL> (60)
http://www.selleckchem.com/products/ly3200882.html

$$$$
