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302962-49-8

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

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Imatinib Mesylate (STI571)

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CGP-57148B, ST-1571 Mesylate

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PDGFR, c-Kit, Bcr-Abl

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Mesylate

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220127-57-1

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

$$$$
untitled.cdx
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Bcr-Abl

>  <Form> (3)
Free Base

>  <CAS> (3)
641571-10-0

>  <URL> (3)
http://www.selleckchem.com/products/Nilotinib.html

$$$$
untitled.cdx
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M  END
>  <Mol_ID> (4)
32

>  <Formula> (4)
C23H28N8OS

>  <MolWeight> (4)
464.58642

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S1048

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VX-680 (MK-0457, Tozasertib)

>  <Synonyms> (4)
N/A 

>  <Target> (4)
Aurora Kinase

>  <Form> (4)
Free Base

>  <CAS> (4)
639089-54-6

>  <URL> (4)
http://www.selleckchem.com/products/VX-680(MK-0457).html

$$$$
Y-27632 2HCL.cdx
csChFnd80/10262011462D

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>  <Mol_ID> (5)
33

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C14H23Cl2N3O

>  <MolWeight> (5)
320.25792

>  <Cat> (5)
S1049

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Y-27632 2HCl

>  <Synonyms> (5)
N/A

>  <Target> (5)
ROCK

>  <Form> (5)
Dihydrochloride

>  <CAS> (5)
129830-38-2

>  <URL> (5)
http://www.selleckchem.com/products/Y-27632.html

$$$$
untitled.cdx
csChFnd80/10262011462D

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>  <Mol_ID> (6)
36

>  <Formula> (6)
C32H29N5O2

>  <MolWeight> (6)
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>  <Cat> (6)
S1055

>  <Name> (6)
Enzastaurin (LY317615)

>  <Synonyms> (6)
N/A 

>  <Target> (6)
PKC 

>  <Form> (6)
Free Base

>  <CAS> (6)
170364-57-5

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

$$$$
untitled.cdx
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M  END
>  <Mol_ID> (7)
42

>  <Formula> (7)
C22H16N4O3

>  <MolWeight> (7)
384.38744

>  <Cat> (7)
S1067

>  <Name> (7)
SB 431542

>  <Synonyms> (7)
N/A

>  <Target> (7)
TGF-beta/Smad

>  <Form> (7)
Free Base

>  <CAS> (7)
301836-41-9

>  <URL> (7)
http://www.selleckchem.com/products/SB-431542.html

$$$$
NVP-ADW742.cdx
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475488-23-4

>  <URL> (8)
http://www.selleckchem.com/products/NVP-ADW742.html

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827318-97-8

>  <URL> (9)
http://www.selleckchem.com/products/PHA-739358(Danusertib).html

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N/A

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Bcr-Abl, JAK, Aurora Kinase

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Free Base

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896466-04-9

>  <URL> (10)
http://www.selleckchem.com/products/AT9283.html

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ROCK

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1226056-71-8

>  <URL> (11)
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TGF-beta/Smad

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943319-70-8

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1020172-07-9

>  <URL> (16)
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TGF-beta/Smad

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Free Base

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452342-67-5

>  <URL> (17)
http://www.selleckchem.com/products/gw788388.html

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N/A 

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TGF-beta/Smad 

>  <Form> (18)
Free Base

>  <CAS> (18)
694433-59-5

>  <URL> (18)
http://www.selleckchem.com/products/sb-505124.html

$$$$
Sotrastaurin£¨AEB071£©.cdx
csChFnd80/10262011462D

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PKC 

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Free Base

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425637-18-9

>  <URL> (19)
http://www.selleckchem.com/products/sotrastaurin-aeb071.html

$$$$
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>  <Formula> (20)
C15H10O7

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Quercetin (Sophoretin)

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117-39-5

>  <URL> (20)
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$$$$
KW2449.cdx
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   11.2316    3.9898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (21)
655

>  <Formula> (21)
C20H20N4O

>  <MolWeight> (21)
332.399

>  <Cat> (21)
S2158

>  <Name> (21)
KW 2449

>  <Synonyms> (21)
N/A

>  <Target> (21)
Flt, Bcr-Abl, Aurora Kinase

>  <Form> (21)
Free Base

>  <CAS> (21)
1000669-72-6

>  <URL> (21)
http://www.selleckchem.com/products/KW-2449.html

$$$$
Daphnetin.cdx
csChFnd80/10262011462D

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M  END
>  <Mol_ID> (22)
659

>  <Formula> (22)
C9H6O4

>  <MolWeight> (22)
178.14154

>  <Cat> (22)
S2554

>  <Name> (22)
Daphnetin

>  <Synonyms> (22)
N/A 

>  <Target> (22)
DNA/RNA Synthesis

>  <Form> (22)
Free Base

>  <CAS> (22)
486-35-1

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

$$$$
NVP-BHG712.cdx
csChFnd80/10262011462D

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 18 13  1  0  0  0  0
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 23 12  1  0  0  0  0
 23 24  1  0  0  0  0
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 25 28  2  0  0  0  0
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 29 30  1  0  0  0  0
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M  END
>  <Mol_ID> (23)
679

>  <Formula> (23)
C26H20F3N7O

>  <MolWeight> (23)
503.4785096

>  <Cat> (23)
S2202

>  <Name> (23)
NVP-BHG712

>  <Synonyms> (23)
N/A

>  <Target> (23)
VEGFR, Src, Raf, Bcr-Abl

>  <Form> (23)
Free Base

>  <CAS> (23)
940310-85-0

>  <URL> (23)
http://www.selleckchem.com/products/NVP-BHG712.html

$$$$
Hesperetin.cdx
csChFnd80/10262011462D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
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M  END
>  <Mol_ID> (24)
731

>  <Formula> (24)
C16H14O6

>  <MolWeight> (24)
302.27876

>  <Cat> (24)
S2308

>  <Name> (24)
Hesperetin

>  <Synonyms> (24)
N/A

>  <Target> (24)
Histamine Receptor

>  <Form> (24)
Free Base

>  <CAS> (24)
520-33-2

>  <URL> (24)
http://www.selleckchem.com/products/Hesperetin.html

$$$$
Myricitrin.cdx
csChFnd80/10262011462D

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 20 15  1  0  0  0  0
 18 21  1  0  0  0  0
 19 22  1  0  0  0  0
 17 23  1  0  0  0  0
 24 14  1  1  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
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 29 24  1  0  0  0  0
 29 30  1  6  0  0  0
 28 31  1  6  0  0  0
 27 32  1  1  0  0  0
 26 33  1  6  0  0  0
M  END
>  <Mol_ID> (25)
746

>  <Formula> (25)
C21H20O12

>  <MolWeight> (25)
464.3763

>  <Cat> (25)
S2327

>  <Name> (25)
Myricitrin (Myricitrine)

>  <Synonyms> (25)
Myricitrine, Myricitroside, Myricetol 3-rhamnoside, Myricetin 3-O-rhamnoside 

>  <Target> (25)
PKC

>  <Form> (25)
Free Base

>  <CAS> (25)
17912-87-7

>  <URL> (25)
http://www.selleckchem.com/products/Myricitrin(Myricitrine).html

$$$$
Oxymatrine.cdx
csChFnd80/10262011462D

 23 26  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
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 13  6  1  0  0  0  0
 11 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
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 17 12  1  0  0  0  0
 17 18  2  0  0  0  0
 11 19  1  1  0  0  0
  5 20  1  6  0  0  0
 10 21  1  6  0  0  0
  6 22  1  6  0  0  0
  4 23  1  0  0  0  0
M  END
>  <Mol_ID> (26)
755

>  <Formula> (26)
C15H24N2O2

>  <MolWeight> (26)
264.36326

>  <Cat> (26)
S2338

>  <Name> (26)
Oxymatrine (Matrine N-oxide)

>  <Synonyms> (26)
Matrine N-oxide, Matrine oxide, Matrine 1beta-oxide 

>  <Target> (26)
Others

>  <Form> (26)
Free Base

>  <CAS> (26)
16837-52-8 

>  <URL> (26)
http://www.selleckchem.com/products/Oxymatrine(Matrine-N-oxide).html

$$$$

csChFnd80/10262011462D

 34 34  0  0  0  0  0  0  0  0999 V2000
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    4.0169   -7.7100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.2335   -5.6027    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.4502   -7.7100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.7332   -9.1100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  4  7  1  0  0  0  0
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  8  9  2  0  0  0  0
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 10  5  1  0  0  0  0
  8 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14  9  1  0  0  0  0
  6 15  1  0  0  0  0
  3 16  1  0  0  0  0
 10 17  2  0  0  0  0
  7 18  2  0  0  0  0
 14 19  1  0  0  0  0
 11 20  1  0  0  0  0
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 21 22  1  0  0  0  0
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 23 24  1  0  0  0  0
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 25 26  1  0  0  0  0
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 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
M  END
>  <Mol_ID> (27)
802

>  <Formula> (27)
C22H30Cl2N4O6

>  <MolWeight> (27)
517.4028

>  <Cat> (27)
S2485

>  <Name> (27)
Mitoxantrone 2HCl

>  <Synonyms> (27)
NSC-301739

>  <Target> (27)
Topoisomerase

>  <Form> (27)
Dihydrochloride

>  <CAS> (27)
70476-82-3

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

$$$$
PP121.cdx
csChFnd80/10262011462D

 24 28  0  0  0  0  0  0  0  0999 V2000
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 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
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 13 14  1  0  0  0  0
 14 10  1  0  0  0  0
  1 11  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
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 19 15  1  0  0  0  0
 12 20  1  0  0  0  0
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 23 13  1  0  0  0  0
 20 24  1  0  0  0  0
M  END
>  <Mol_ID> (28)
858

>  <Formula> (28)
C17H17N7

>  <MolWeight> (28)
319.36378

>  <Cat> (28)
S2622

>  <Name> (28)
PP-121

>  <Synonyms> (28)
N/A

>  <Target> (28)
DNA-PK, mTOR, PDGF

>  <Form> (28)
Free Base

>  <CAS> (28)
1092788-83-4

>  <URL> (28)
http://www.selleckchem.com/products/PP121.html

$$$$
LY2157299.cdx
csChFnd80/10262011462D

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 13  8  1  0  0  0  0
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M  END
>  <Mol_ID> (29)
871

>  <Formula> (29)
C22H19N5O

>  <MolWeight> (29)
369.41916

>  <Cat> (29)
S2230

>  <Name> (29)
Galunisertib (LY2157299)

>  <Synonyms> (29)
N/A 

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

>  <Form> (29)
Free Base

>  <CAS> (29)
700874-72-2

>  <URL> (29)
http://www.selleckchem.com/products/ly2157299.html

$$$$
937174-76-0.cdx
csChFnd80/10262011462D

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937174-76-0

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153436-53-4

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Pirfenidone

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TGF-beta/Smad

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53179-13-8

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

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PKC

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133053-19-7

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http://www.selleckchem.com/products/go-6983.html

$$$$
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Sulfasalazine (Azulfidine)

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COX,NF-¦ÊB

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599-79-1

>  <URL> (34)
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$$$$
GNF-2.cdx
csChFnd80/10262011462D

 27 29  0  0  0  0  0  0  0  0999 V2000
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    3.4927    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.4927    2.4249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (35)
1244

>  <Formula> (35)
C18H13F3N4O2

>  <MolWeight> (35)
374.3166296

>  <Cat> (35)
S2899

>  <Name> (35)
GNF-2

>  <Synonyms> (35)
N/A

>  <Target> (35)
Bcr-Abl

>  <Form> (35)
Free Base

>  <CAS> (35)
778270-11-4

>  <URL> (35)
http://www.selleckchem.com/products/gnf-2.html

$$$$
NS-187.cdx
csChFnd80/10262011462D

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M  END
>  <Mol_ID> (36)
1745

>  <Formula> (36)
C30H31F3N8O

>  <MolWeight> (36)
576.6153496

>  <Cat> (36)
S1369

>  <Name> (36)
Bafetinib (INNO-406)

>  <Synonyms> (36)
NS-187

>  <Target> (36)
Abl,Lyn

>  <Form> (36)
Free Base

>  <CAS> (36)
859212-16-1

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

$$$$
S3609 Berbamine (dihydrochloride).cdx
csChFnd80/10262011462D

 47 51  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (37)
1748

>  <Formula> (37)
C37H42Cl2N2O6

>  <MolWeight> (37)
681.64518

>  <Cat> (37)
S3609

>  <Name> (37)
Berbamine (dihydrochloride)

>  <Synonyms> (37)
N/A

>  <Target> (37)
NF-¦ÊB,bcr/abl

>  <Form> (37)
dihydrochloride

>  <CAS> (37)
6078-17-7

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

$$$$
S3616 Asiaticoside.cdx
csChFnd80/10262011462D

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>  <Mol_ID> (38)
1763

>  <Formula> (38)
C48H78O19

>  <MolWeight> (38)
959.12152

>  <Cat> (38)
S3616

>  <Name> (38)
Asiaticoside

>  <Synonyms> (38)
Ba 2742, BRN0078195, CCRIS8995, NSC166062, Emdecassol,Madecassol

>  <Target> (38)
Others

>  <Form> (38)
free base

>  <CAS> (38)
16830-15-2

>  <URL> (38)
http://www.selleckchem.com/products/asiaticoside.html

$$$$
S3661 2-Methoxy-1,4-naphthoquinone.cdx
csChFnd80/10262011462D

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M  END
>  <Mol_ID> (39)
1788

>  <Formula> (39)
C11H8O3

>  <MolWeight> (39)
188.17942

>  <Cat> (39)
S3661

>  <Name> (39)
2-Methoxy-1,4-naphthoquinone

>  <Synonyms> (39)
N/A

>  <Target> (39)
PKC

>  <Form> (39)
free base

>  <CAS> (39)
2348-82-5

>  <URL> (39)
http://www.selleckchem.com/products/2-methoxy-1-4-naphthoquinone.html

$$$$
S3819 Decursinol angelate.cdx
csChFnd80/10262011462D

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M  END
>  <Mol_ID> (40)
1892

>  <Formula> (40)
C19H20O5

>  <MolWeight> (40)
328.3591

>  <Cat> (40)
S3819

>  <Name> (40)
Decursinol angelate

>  <Synonyms> (40)
N/A

>  <Target> (40)
PKC

>  <Form> (40)
free base

>  <CAS> (40)
130848-06-5

>  <URL> (40)
http://www.selleckchem.com/products/decursinol-angelate.html

$$$$
LY2109761.cdx
csChFnd80/10262011462D

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>  <Mol_ID> (41)
2002

>  <Formula> (41)
C26H27N5O2

>  <MolWeight> (41)
441.52488

>  <Cat> (41)
S2704

>  <Name> (41)
LY2109761

>  <Synonyms> (41)
N/A

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396129-53-6

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Bcr-Abl

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1421783-64-3

>  <URL> (43)
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>  <URL> (44)
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2284

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free base

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 11013-97-1

$$$$
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csChFnd80/10262011462D

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>  <Target> (46)
Akt

>  <Form> (46)
Free Base

>  <CAS> (46)
1143532-39-1

>  <URL> (46)
http://www.selleckchem.com/products/azd5363.html

$$$$
Isoxazole 9 (ISX-9).cdx
csChFnd80/10262011462D

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C11H10N2O2S

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Isoxazole 9 (ISX-9)

>  <Synonyms> (47)
N/A

>  <Target> (47)
Others

>  <Form> (47)
Free Base

>  <CAS> (47)
832115-62-5

>  <URL> (47)
http://www.selleckchem.com/products/isoxazole-9-isx-9.html

$$$$
RepSox (E-616452, SJN 2511).cdx
csChFnd80/10262011462D

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>  <Mol_ID> (48)
2629

>  <Formula> (48)
C17H13N5

>  <MolWeight> (48)
287.31862

>  <Cat> (48)
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RepSox

>  <Synonyms> (48)
E-616452, SJN 2511

>  <Target> (48)
TGF-beta/Smad

>  <Form> (48)
Free Base

>  <CAS> (48)
446859-33-2

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

$$$$
Ro 31-8220 mesylate.cdx
csChFnd80/10262011462D

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>  <Mol_ID> (49)
2640

>  <Formula> (49)
C26H27N5O5S2

>  <MolWeight> (49)
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>  <Cat> (49)
S7207

>  <Name> (49)
Ro 31-8220 Mesylate

>  <Synonyms> (49)
Bisindolylmaleimide IX Mesylate

>  <Target> (49)
PKC

>  <Form> (49)
Mesylate

>  <CAS> (49)
138489-18-6

>  <URL> (49)
http://www.selleckchem.com/products/ro-31-8220-mesylate.html

$$$$
Dorsomorphin dihydrochloride(BML-275,Compound C).cdx
csChFnd80/10262011462D

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M  END
>  <Mol_ID> (50)
2650

>  <Formula> (50)
C24H27Cl2N5O

>  <MolWeight> (50)
472.41008

>  <Cat> (50)
S7306

>  <Name> (50)
Dorsomorphin (Compound C) 2HCl

>  <Synonyms> (50)
BML-275,Compound C

>  <Target> (50)
AMPK

>  <Form> (50)
Dihydrochloride

>  <CAS> (50)
1219168-18-9

>  <URL> (50)
http://www.selleckchem.com/products/dorsomorphin-2hcl.html

$$$$
LM-3151 K 02288.cdx
csChFnd80/10262011462D

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M  END
>  <Mol_ID> (51)
2752

>  <Formula> (51)
C20H20N2O4

>  <MolWeight> (51)
352.3838

>  <Cat> (51)
S7359

>  <Name> (51)
K02288

>  <Synonyms> (51)
N/A

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

>  <Form> (51)
Free Base

>  <CAS> (51)
1431985-92-0

>  <URL> (51)
http://www.selleckchem.com/products/k02288.html

$$$$
LDN193189 HCl.cdx
csChFnd80/10262011462D

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M  END
>  <Mol_ID> (52)
2773

>  <Formula> (52)
C25H23ClN6

>  <MolWeight> (52)
442.94332

>  <Cat> (52)
S7507

>  <Name> (52)
LDN193189 HCl

>  <Synonyms> (52)
N/A

>  <Target> (52)
TGF-beta/Smad

>  <Form> (52)
Hydrochloride

>  <CAS> (52)
1062368-62-0

>  <URL> (52)
http://www.selleckchem.com/products/ldn-193189-HCl.html

$$$$
ML347.cdx
csChFnd80/10262011462D

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M  END
>  <Mol_ID> (53)
2787

>  <Formula> (53)
C22H16N4O

>  <MolWeight> (53)
352.38864

>  <Cat> (53)
S7148

>  <Name> (53)
ML347

>  <Synonyms> (53)
N/A

>  <Target> (53)
TGF-beta/Smad

>  <Form> (53)
Free Base

>  <CAS> (53)
1062368-49-3

>  <URL> (53)
http://www.selleckchem.com/products/ml347.html

$$$$
K-Ras(G12C) inhibitor 6.cdx
csChFnd80/10262011462D

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Rho

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TGF-beta/Smad

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1206711-16-1

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TGF-beta/Smad

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Free Base

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1432597-26-6

>  <URL> (56)
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 27 28  1  0  0  0  0
  6 29  1  0  0  0  0
M  END
>  <Mol_ID> (58)
2859

>  <Formula> (58)
C21H18Cl2N4OS

>  <MolWeight> (58)
445.36482

>  <Cat> (58)
S7269

>  <Name> (58)
PD173955

>  <Synonyms> (58)
N/A 

>  <Target> (58)
Bcr-Abl

>  <Form> (58)
Free Base

>  <CAS> (58)
260415-63-2

>  <URL> (58)
http://www.selleckchem.com/products/pd173955.html

$$$$
K-Ras(G12C) inhibitor 9.cdx
csChFnd80/10262011462D

 26 27  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
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    8.4870    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (59)
2863

>  <Formula> (59)
C16H21ClIN3O4S

>  <MolWeight> (59)
513.77811

>  <Cat> (59)
S7332

>  <Name> (59)
K-Ras(G12C) inhibitor 9

>  <Synonyms> (59)
N/A

>  <Target> (59)
Rho

>  <Form> (59)
Free Base

>  <CAS> (59)
1469337-91-4

>  <URL> (59)
http://www.selleckchem.com/products/k-ras-g12c-inhibitor9.html

$$$$
6H05.cdx
csChFnd80/10262011462D

 36 36  0  0  0  0  0  0  0  0999 V2000
    1.2124    4.6193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.2193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.5193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0907    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  4  8  1  0  0  0  0
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 34 35  2  0  0  0  0
 34 36  1  0  0  0  0
M  END
>  <Mol_ID> (60)
2883

>  <Formula> (60)
C22H31ClF3N3O4S3

>  <MolWeight> (60)
590.1424496

>  <Cat> (60)
S7330

>  <Name> (60)
6H05

>  <Synonyms> (60)
N/A

>  <Target> (60)
Rho

>  <Form> (60)
Free Base

>  <CAS> (60)
No

>  <URL> (60)
http://www.selleckchem.com/products/6h05.html

$$$$
K-Ras(G12C) inhibitor 12.cdx
csChFnd80/10262011462D

 23 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
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 17 20  1  0  0  0  0
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M  END
>  <Mol_ID> (61)
2897

>  <Formula> (61)
C15H17ClIN3O3

>  <MolWeight> (61)
449.67125

>  <Cat> (61)
S7331

>  <Name> (61)
K-Ras(G12C) inhibitor 12

>  <Synonyms> (61)
N/A

>  <Target> (61)
Rho

>  <Form> (61)
Free Base

>  <CAS> (61)
1469337-95-8

>  <URL> (61)
http://www.selleckchem.com/products/k-ras-g12c-inhibitor-12.html

$$$$
EW-7197.cdx
csChFnd80/10262011462D

 30 34  0  0  0  0  0  0  0  0999 V2000
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 20  9  1  0  0  0  0
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M  END
>  <Mol_ID> (62)
2915

>  <Formula> (62)
C22H18FN7

>  <MolWeight> (62)
399.4236232

>  <Cat> (62)
S7530

>  <Name> (62)
EW-7197

>  <Synonyms> (62)
N/A

>  <Target> (62)
TGF-beta/Smad

>  <Form> (62)
Free Base

>  <CAS> (62)
1352608-82-2

>  <URL> (62)
http://www.selleckchem.com/products/ew-7197.html

$$$$
Kartogenin.cdx
csChFnd80/10262011462D

 24 26  0  0  0  0  0  0  0  0999 V2000
   10.9119    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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Dasatinib Monohydrate

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BMS-354825 Monohydrate

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Src

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Monohydrate

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863127-77-9

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

$$$$
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C18H17Cl2FN4OS

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N/A

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Akt

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Free Base

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1047644-62-1

>  <URL> (69)
http://www.selleckchem.com/products/afuresertib-gsk2110183.html

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LDN-214117

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N/A

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TGF-beta/Smad

>  <Form> (70)
Free Base

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1627503-67-6

>  <URL> (70)
http://www.selleckchem.com/products/ldn-214117.html

$$$$
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csChFnd80/10262011462D

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AMPK

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Free Base

>  <CAS> (71)
866405-64-3

>  <URL> (71)
http://www.selleckchem.com/products/dorsomorphin.html

$$$$
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csChFnd80/10262011462D

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>  <Mol_ID> (72)
3109

>  <Formula> (72)
C27H21F3N8O

>  <MolWeight> (72)
530.5038496

>  <Cat> (72)
S8134

>  <Name> (72)
Radotinib

>  <Synonyms> (72)
IY-5511

>  <Target> (72)
Bcr-Abl

>  <Form> (72)
Free Base

>  <CAS> (72)
926037-48-1

>  <URL> (72)
http://www.selleckchem.com/products/radotinib.html

$$$$
Ripasudil (K-115) hydrochloride dihydrate.cdx
csChFnd80/10262011462D

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M  END
>  <Mol_ID> (73)
3110

>  <Formula> (73)
C15H23ClFN3O4S

>  <MolWeight> (73)
395.8772232

>  <Cat> (73)
S7995

>  <Name> (73)
Ripasudil (K-115)

>  <Synonyms> (73)
N/A

>  <Target> (73)
ROCK

>  <Form> (73)
Hydrochloride dihydrate

>  <CAS> (73)
887375-67-9

>  <URL> (73)
http://www.selleckchem.com/products/ripasudil-k-115.html

$$$$
GNF-7.cdx
csChFnd80/10262011462D

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M  END
>  <Mol_ID> (74)
3115

>  <Formula> (74)
C28H24F3N7O2

>  <MolWeight> (74)
547.5310696

>  <Cat> (74)
S8140

>  <Name> (74)
GNF-7

>  <Synonyms> (74)
N/A

>  <Target> (74)
Bcr-Abl

>  <Form> (74)
Free Base

>  <CAS> (74)
839706-07-9

>  <URL> (74)
http://www.selleckchem.com/products/gnf-7.html

$$$$
KD025 (SLx-2119).cdx
csChFnd80/10262011462D

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KD025 (SLx-2119)

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ROCK

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Free Base

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911417-87-3

>  <URL> (75)
http://www.selleckchem.com/products/kd025-(slx-2119).html

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Rho

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Free Base

>  <CAS> (76)
436133-68-5

>  <URL> (76)
http://www.selleckchem.com/products/kobe0065.html

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LY333531.cdx
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3257

>  <Formula> (77)
C28H29ClN4O3

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>  <Name> (77)
LY333531 HCl

>  <Synonyms> (77)
Ruboxistaurin

>  <Target> (77)
PKC

>  <Form> (77)
hydrochloride

>  <CAS> (77)
169939-93-9

>  <URL> (77)
http://www.selleckchem.com/products/ly333531.html

$$$$
SIS3.cdx
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3261

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C28H28ClN3O3

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489.99322

>  <Cat> (78)
S7959

>  <Name> (78)
SIS3 HCl

>  <Synonyms> (78)
N/A

>  <Target> (78)
TGF-beta/Smad

>  <Form> (78)
hydrochloride

>  <CAS> (78)
521984-48-5

>  <URL> (78)
http://www.selleckchem.com/products/sis3.html

$$$$
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Alantolactone

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helenin, helenine, Eupatal

>  <Target> (79)
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>  <Form> (79)
Free Base

>  <CAS> (79)
546-43-0

>  <URL> (79)
http://www.selleckchem.com/products/alantolactone.html

$$$$
GSK269962.cdx
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    2.4249    7.3293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    6.6293    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6373   13.6293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2746   15.7293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4249    3.1293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6373    2.4293    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    3.1293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.4293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    3.1293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    4.5293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    5.2293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.6519    2.6967    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.9834    3.1293    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9834    4.5293    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.6519    4.9620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2193    6.2934    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.4800    0.0000    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
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  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  6  7  1  0  0  0  0
  3  8  1  0  0  0  0
  8  9  2  0  0  0  0
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 11 12  1  0  0  0  0
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 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 13  1  0  0  0  0
 10 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
 23 24  2  0  0  0  0
 24 19  1  0  0  0  0
 23 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 27 28  1  0  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 31 26  1  0  0  0  0
 28 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  2  0  0  0  0
 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
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 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> (80)
3312

>  <Formula> (80)
C29H31ClN8O5

>  <MolWeight> (80)
607.06004

>  <Cat> (80)
S7687

>  <Name> (80)
GSK269962 HCl

>  <Synonyms> (80)
GSK 269962, GSK-269962, GSK269962A, GSK 269962A, GSK-269962A, GSK269962B

>  <Target> (80)
ROCK

>  <Form> (80)
hydrochloride

>  <CAS> (80)
850664-21-0(free base)

>  <URL> (80)
http://www.selleckchem.com/products/gsk269962.html

$$$$
ML-7.cdx
csChFnd80/10262011462D

 22 23  0  0  0  0  0  0  0  0999 V2000
    0.0000    3.5000    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
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    2.4249    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6373    1.4000    0.0000 C   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
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    2.3760    7.6074    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
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
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 10  5  1  0  0  0  0
  3 11  1  0  0  0  0
 10 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
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 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
M  END
>  <Mol_ID> (81)
3328

>  <Formula> (81)
C15H18ClIN2O2S

>  <MolWeight> (81)
452.73809

>  <Cat> (81)
S8388

>  <Name> (81)
ML-7 HCl

>  <Synonyms> (81)
N/A

>  <Target> (81)
Others

>  <Form> (81)
hydrochloride

>  <CAS> (81)
110448-33-4

>  <URL> (81)
http://www.selleckchem.com/products/ml-7.html

$$$$
Y-39983 HCl.cdx
csChFnd80/10262011462D

 24 24  0  0  0  0  0  0  0  0999 V2000
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  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
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 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
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 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> (82)
3339

>  <Formula> (82)
C16H18Cl2N4O

>  <MolWeight> (82)
353.24632

>  <Cat> (82)
S7935

>  <Name> (82)
Y-39983 HCl

>  <Synonyms> (82)
Y-33075 HCl

>  <Target> (82)
ROCK

>  <Form> (82)
dihydrochloride

>  <CAS> (82)
173897-44-4

>  <URL> (82)
http://www.selleckchem.com/products/y-39983-hcl.html

$$$$
ZINC00881524 (ROCK inhibitor).cdx
csChFnd80/10262011462D

 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
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   12.6743    7.2686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.2495    7.2686    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
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  2  7  1  0  0  0  0
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 10  3  1  0  0  0  0
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 11 12  2  0  0  0  0
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 13  8  1  0  0  0  0
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 14 15  1  0  0  0  0
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 25 26  1  0  0  0  0
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M  END
>  <Mol_ID> (83)
3343

>  <Formula> (83)
C21H20N2O3S

>  <MolWeight> (83)
380.4601

>  <Cat> (83)
S8448

>  <Name> (83)
ZINC00881524 (ROCK inhibitor)

>  <Synonyms> (83)
N/A

>  <Target> (83)
ROCK

>  <Form> (83)
Free Base

>  <CAS> (83)
557782-81-7

>  <URL> (83)
http://www.selleckchem.com/products/zinc00881524-rock-inhibitor.html

$$$$
Hydroxyfasudil (HA-1100).cdx
csChFnd80/10262011462D

 23 23  0  0  0  0  0  0  0  0999 V2000
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>  <URL> (85)
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K-Ras(G12C)

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free base

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1629268-00-3

>  <URL> (86)
http://www.selleckchem.com/products/ars-853.html

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1492952-76-7

>  <URL> (87)
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   15.7635    5.6078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.9782    7.7055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6138    8.4065    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.6133    5.6060    0.0000 O   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
  1  4  2  0  0  0  0
  1  5  1  0  0  0  0
  6  7  1  0  0  0  0
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  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
  6 11  2  0  0  0  0
  9 12  1  0  0  0  0
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  3  6  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
 14 19  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
 25 26  1  0  0  0  0
 21 26  1  0  0  0  0
 26 27  1  1  0  0  0
 25 28  1  6  0  0  0
 24 29  1  1  0  0  0
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 22 20  1  6  0  0  0
 17 20  1  1  0  0  0
 31 32  1  0  0  0  0
 15 31  1  1  0  0  0
 18 33  1  6  0  0  0
 35 36  1  0  0  0  0
 34 35  1  0  0  0  0
 37 38  1  0  0  0  0
 38 39  2  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
 37 42  2  0  0  0  0
 40 43  1  0  0  0  0
 39 44  1  0  0  0  0
 36 37  1  0  0  0  0
 19 34  1  1  0  0  0
 16  5  1  6  0  0  0
M  END
>  <Mol_ID> (88)
3925

>  <Formula> (88)
C29H36O15

>  <MolWeight> (88)
624.58714

>  <Cat> (88)
S5458

>  <Name> (88)
Verbascoside

>  <Synonyms> (88)
Acteoside, Kusaginin

>  <Target> (88)
Immunology & Inflammation related

>  <Form> (88)
free base

>  <CAS> (88)
61276-17-3

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

$$$$
S5205 Nilotinib  hydrochloride.cdx
csChFnd80/10262011462D

 40 43  0  0  0  0  0  0  0  0999 V2000
   12.1246    2.7998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9121    2.0998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9121    0.6998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1246    4.1998    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3371    2.0998    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2748    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.3135    4.2145    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
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M  END
>  <Mol_ID> (89)
4026

>  <Formula> (89)
C28H23ClF3N7O

>  <MolWeight> (89)
565.9767296

>  <Cat> (89)
S5205

>  <Name> (89)
Nilotinib hydrochloride

>  <Synonyms> (89)
AMN-107 HCl

>  <Target> (89)
Bcr-Abl

>  <Form> (89)
hydrochloride 

>  <CAS> (89)
923288-95-3

>  <URL> (89)
http://selleckchem.com/products/nilotinib-hydrochloride.html

$$$$

csChFnd80/10262011462D

 21 23  0  0  0  0  0  0  0  0999 V2000
    2.7374    2.1544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.4374    0.0000    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
  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
  4 10  1  0  0  0  0
 10 11  1  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 10  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 19  1  0  0  0  0
 19 15  1  0  0  0  0
 17 20  1  0  0  0  0
M  END
>  <Mol_ID> (90)
4258

>  <Formula> (90)
C14H11ClN4S2

>  <MolWeight> (90)
334.84694

>  <Cat> (90)
S8700

>  <Name> (90)
TP0427736 HCl

>  <Synonyms> (90)
N/A

>  <Target> (90)
ALK

>  <Form> (90)
hydrochloride

>  <CAS> (90)
864374-00-5

>  <URL> (90)
http://www.selleckchem.com/products/tp0427736-hcl.html

$$$$

csChFnd80/10262011462D

 25 28  0  0  0  0  0  0  0  0999 V2000
    3.5543    4.1637    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.5543    2.7637    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
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    4.6490    5.0366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2229    4.5964    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  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  6  0  0  0
  1  7  1  6  0  0  0
  1  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
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
 13  1  1  0  0  0  0
 12 14  1  0  0  0  0
 14  6  1  0  0  0  0
 12 15  1  1  0  0  0
 14 15  1  1  0  0  0
  4 16  1  0  0  0  0
 10 17  1  1  0  0  0
  2 18  1  1  0  0  0
  3 19  1  1  0  0  0
 13 20  1  6  0  0  0
 15 21  1  0  0  0  0
 15 22  1  0  0  0  0
  7 23  2  0  0  0  0
  9 24  1  0  0  0  0
 16 25  1  0  0  0  0
M  END
>  <Mol_ID> (91)
4349

>  <Formula> (91)
C20H28O5

>  <MolWeight> (91)
348.43332

>  <Cat> (91)
S9101

>  <Name> (91)
Ingenol

>  <Form> (91)
free base

>  <CAS> (91)
30220-46-3

$$$$
S9141 Berbamine.cdx
csChFnd80/10262011462D

 45 51  0  0  0  0  0  0  0  0999 V2000
    0.0000    6.8574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.1420    7.8630    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6222    9.2220    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5868   10.2568    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1904    9.9220    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9768   12.5942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9667   11.6042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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478-61-5

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479-91-4

$$$$
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BMS 354825 hydrochloride

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Abl/Src

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hydrochloride 

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854001-07-3

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

$$$$

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1898283-02-7

>  <URL> (95)
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$$$$

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 10  5  1  0  0  0  0
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  8 26  1  0  0  0  0
M  END
>  <Mol_ID> (96)
5250

>  <Formula> (96)
C21H19ClNO4+

>  <MolWeight> (96)
384.83286

>  <Cat> (96)
S1292

>  <Name> (96)
Chelerythrine Chloride

>  <Synonyms> (96)
N/A

>  <Target> (96)
PKC

>  <Form> (96)
Chloride

>  <CAS> (96)
3895-92-9

>  <URL> (96)
http://www.selleck.cn/products/Chelerythrine-chloride.html

$$$$

csChFnd80/10262011462D

 27 30  0  0  0  0  0  0  0  0999 V2000
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    0.7289    2.1055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  4  1  2  0  0  0  0
  5  1  1  0  0  0  0
  3  2  1  0  0  0  0
  9  2  2  0  0  0  0
  6  3  1  0  0  0  0
  7  4  1  0  0  0  0
  8  4  1  0  0  0  0
  6  5  2  0  0  0  0
 20  5  1  0  0  0  0
 23  6  1  0  0  0  0
 10  7  2  0  0  0  0
 11  7  1  0  0  0  0
 12  8  1  0  0  0  0
 13  8  2  0  0  0  0
 17 10  1  0  0  0  0
 19 11  2  0  0  0  0
 16 12  2  0  0  0  0
 18 13  1  0  0  0  0
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 21 14  1  0  0  0  0
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 22 15  1  0  0  0  0
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 26 20  2  0  0  0  0
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 25 22  1  0  0  0  0
 23 27  2  0  0  0  0
 27 26  1  0  0  0  0
M  END
>  <Mol_ID> (97)
5330

>  <Formula> (97)
C23H19NO3

>  <MolWeight> (97)
357.40186

>  <Cat> (97)
S6424

>  <Name> (97)
TAS-301

>  <Synonyms> (97)
N/A

>  <Target> (97)
Others

>  <Form> (97)
Free Base

>  <CAS> (97)
193620-69-8

>  <URL> (97)
http://www.selleck.cn/products/tas-301.html

$$$$

csChFnd80/10262011462D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0  0  0  0
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 11 12  2  0  0  0  0
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 13 14  2  0  0  0  0
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 10 13  1  0  0  0  0
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 16 21  2  0  0  0  0
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  3  6  1  0  0  0  0
M  END
>  <Mol_ID> (98)
6694

>  <Formula> (98)
C16H14N2O2S2

>  <MolWeight> (98)
330.42456

>  <Cat> (98)
S6536

>  <Name> (98)
TTP 22

>  <Synonyms> (98)
N/A

>  <Target> (98)
Casein Kinase

>  <Form> (98)
free base

>  <CAS> (98)
329907-28-0

>  <URL> (98)
http://www.selleck.cn/products/ttp-22.html

$$$$

csChFnd80/10262011462D

 32 34  0  0  0  0  0  0  0  0999 V2000
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   10.9119    7.0000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
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 29 31  1  0  0  0  0
 30 31  2  0  0  0  0
M  END
>  <Mol_ID> (99)
6716

>  <Formula> (99)
C20H25F3N6O3

>  <MolWeight> (99)
454.4461096

>  <Cat> (99)
S6577

>  <Name> (99)
PKC-theta inhibitor

>  <Synonyms> (99)
N/A

>  <Target> (99)
PKC

>  <Form> (99)
free base

>  <CAS> (99)
736048-65-0

>  <URL> (99)
http://www.selleck.cn/products/pkc-theta-inhibitor.html

$$$$

csChFnd80/10262011462D

 28 31  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (100)
6798

>  <Formula> (100)
C18H13ClF2N6O

>  <MolWeight> (100)
402.7852264

>  <Cat> (100)
S6636

>  <Name> (100)
Azaindole 1 (TC-S 7001)

>  <Synonyms> (100)
N/A

>  <Target> (100)
ROCK

>  <Form> (100)
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>  <CAS> (100)
867017-68-3

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1099644-42-4

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PKC

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1874276-76-2

>  <URL> (102)
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1315355-93-1

>  <URL> (103)
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>  <URL> (104)
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334951-90-5

>  <URL> (105)
http://www.selleck.cn/products/bibf-0775.html

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csChFnd80/10262011462D

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N/A

>  <Target> (106)
TGF-beta/Smad

>  <Form> (106)
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>  <CAS> (106)
1629138-41-5

>  <URL> (106)
http://www.selleck.cn/products/sri-011381.html

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>  <Formula> (107)
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>  <MolWeight> (107)
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>  <Synonyms> (107)
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>  <Target> (107)
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>  <Form> (107)
Free Base

>  <CAS> (107)
1922098-69-8

>  <URL> (107)
http://www.selleck.cn/products/ccg-222740.html

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>  <Formula> (108)
C19H19N5

>  <MolWeight> (108)
317.38766

>  <Cat> (108)
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>  <Synonyms> (108)
N/A

>  <Target> (108)
Src

>  <Form> (108)
Free Base

>  <CAS> (108)
221243-82-9

>  <URL> (108)
http://www.selleckchem.com/products/1-na-pp1.html

$$$$

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   10.1847    2.7791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.2846    3.9915    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   12.9846    2.7791    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9846    5.2040    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.3978    2.4687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5442    1.0764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4115    0.2535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.9863    2.2152    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
  1  6  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
  7 11  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
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 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
 15 18  1  0  0  0  0
  7 12  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
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 25 26  1  0  0  0  0
 21 26  2  0  0  0  0
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  3 10  1  0  0  0  0
M  END
>  <Mol_ID> (109)
6996

>  <Formula> (109)
C20H13FN4O2

>  <MolWeight> (109)
360.3412232

>  <Cat> (109)
S5183

>  <Name> (109)
PD 169316

>  <Synonyms> (109)
N/A

>  <Target> (109)
p38 MAPK

>  <Form> (109)
Free Base

>  <CAS> (109)
152121-53-4

>  <URL> (109)
http://www.selleckchem.com/products/pd-169316.html

$$$$

csChFnd80/10262011462D

 18 20  0  0  0  0  0  0  0  0999 V2000
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  2  6  1  0  0  0  0
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  3  7  1  0  0  0  0
  3  9  1  0  0  0  0
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  5 10  2  0  0  0  0
  5 11  1  0  0  0  0
  7  8  1  0  0  0  0
  7 12  2  0  0  0  0
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 10 16  1  0  0  0  0
 11 17  2  0  0  0  0
 12 14  1  0  0  0  0
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 14 15  2  0  0  0  0
 16 18  2  0  0  0  0
 17 18  1  0  0  0  0
M  END
>  <Mol_ID> (110)
7075

>  <Formula> (110)
C14H10BrNOS

>  <MolWeight> (110)
320.2043

>  <Cat> (110)
S0523

>  <Name> (110)
SB?4

>  <Synonyms> (110)
Benepali, Brenzys, Etanercept biosimilar

>  <Target> (110)
TGF-beta/Smad

>  <Form> (110)
Free Base

>  <CAS> (110)
100874-08-6

>  <URL> (110)
http://www.selleckchem.com/products/sb-4.html

$$$$

csChFnd80/10262011462D

 31 35  0  0  0  0  0  0  0  0999 V2000
    2.3161   10.1849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  4  7  1  0  0  0  0
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  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  7 11  1  0  0  0  0
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 13 14  1  0  0  0  0
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 15 17  1  0  0  0  0
 16 18  2  0  0  0  0
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 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
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 25 20  1  0  0  0  0
 17 26  2  0  0  0  0
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 29 30  2  0  0  0  0
 30 17  1  0  0  0  0
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M  END
>  <Mol_ID> (111)
7107

>  <Formula> (111)
C25H19N5S

>  <MolWeight> (111)
421.51686

>  <Cat> (111)
S7692

>  <Name> (111)
A-83-01

>  <Synonyms> (111)
N/A

>  <Target> (111)
ALK

>  <Form> (111)
Free Base

>  <CAS> (111)
909910-43-6

>  <URL> (111)
http://www.selleckchem.com/products/a-83-01.html

$$$$

csChFnd80/10262011462D

 38 41  0  0  0  0  0  0  0  0999 V2000
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 29 30  2  0  0  0  0
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 35 36  2  0  0  0  0
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 31 38  1  0  0  0  0
M  END
>  <Mol_ID> (112)
7110

>  <Formula> (112)
C30H28O8

>  <MolWeight> (112)
516.53852

>  <Cat> (112)
S7862

>  <Name> (112)
Rottlerin

>  <Synonyms> (112)
Mallotoxin, NSC 56346, NSC 94525

>  <Target> (112)
PKC

>  <Form> (112)
Free Base

>  <CAS> (112)
82-08-6

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

$$$$

csChFnd80/10262011462D

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  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9  5  1  0  0  0  0
  8 10  1  0  0  0  0
 10  1  1  0  0  0  0
  3 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  2  0  0  0  0
 13 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
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 26 28  2  0  0  0  0
M  END
>  <Mol_ID> (113)
7185

>  <Formula> (113)
C23H40N2O3

>  <MolWeight> (113)
392.5753

>  <Cat> (113)
S0752

>  <Name> (113)
AUDA

>  <Target> (113)
Epoxide Hydrolase

>  <Form> (113)
free base

>  <CAS> (113)
479413-70-2

>  <URL> (113)
http://www.selleckchem.com/products/auda.html

$$$$

csChFnd80/10262011462D

 13 13  0  0  0  0  0  0  0  0999 V2000
    2.4250    5.6001    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.2001    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    4.2001    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    1.4000    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
    2.4250    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    4.2001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2126    3.5001    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.6374    3.5001    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.6374    2.1000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.2126    2.1000    0.0000 C   0  0  2  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
    3.6374    6.3001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  7  1  0  0  0  0
  1 13  1  0  0  0  0
  8  2  1  1  0  0  0
  9  3  1  6  0  0  0
 10  4  1  1  0  0  0
 11  5  1  6  0  0  0
  6 12  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 11  1  0  0  0  0
  9 10  1  0  0  0  0
 10 12  1  0  0  0  0
 11 12  1  0  0  0  0
M  END
>  <Mol_ID> (114)
7217

>  <Formula> (114)
C7H14O6

>  <MolWeight> (114)
194.18246

>  <Cat> (114)
S3223

>  <Name> (114)
L-Quebrachitol

>  <Target> (114)
TGF-beta/Smad

>  <Form> (114)
free base

>  <CAS> (114)
642-38-6

>  <URL> (114)
http://www.selleckchem.com/products/l-quebrachitol.html

$$$$

csChFnd80/10262011462D

 37 39  0  0  0  0  0  0  0  0999 V2000
    2.4907    9.9985    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.0907    9.9985    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   12.2725    7.8306    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7559    6.3968    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2178    5.6783    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1963    8.4781    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8309    2.1338    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.3695    6.3967    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.3110    3.5629    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.3110    2.1047    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.8309    3.5338    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.5793    4.2823    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5793    1.3853    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1013    4.2676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0432    1.4338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1013    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0432    4.2337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1067    5.6674    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   12.2556    2.1338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2556    3.5338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8494    6.4063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1067    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0208    5.6918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5295    4.2433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3583    7.8548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8387    7.8063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0843    8.5643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2780    6.4307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5409    5.7014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6425    5.6970    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6208    8.4969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4247    6.3876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4139    7.7875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4822    8.5352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9656    5.6922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.3689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1853    9.8781    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  3 28  1  0  0  0  0
  3 34  1  0  0  0  0
  4 29  1  0  0  0  0
  4 35  1  0  0  0  0
  5 32  1  0  0  0  0
  5 36  1  0  0  0  0
  6 33  1  0  0  0  0
  6 37  1  0  0  0  0
  7 11  1  0  0  0  0
  7 13  1  0  0  0  0
  7 15  1  0  0  0  0
  8 18  1  0  0  0  0
  8 25  1  0  0  0  0
  9 10  1  0  0  0  0
  9 12  1  0  0  0  0
  9 14  1  1  0  0  0
 10 13  1  0  0  0  0
 10 16  1  6  0  0  0
 11 12  1  1  0  0  0
 11 17  1  0  0  0  0
 18 14  1  6  0  0  0
 15 19  1  0  0  0  0
 16 22  1  0  0  0  0
 17 20  1  0  0  0  0
 17 23  2  0  0  0  0
 18 21  1  0  0  0  0
 19 20  1  0  0  0  0
 20 24  2  0  0  0  0
 21 26  1  0  0  0  0
 21 30  2  0  0  0  0
 23 28  1  0  0  0  0
 24 29  1  0  0  0  0
 25 27  1  0  0  0  0
 26 27  1  0  0  0  0
 26 31  2  0  0  0  0
 28 29  2  0  0  0  0
 30 32  1  0  0  0  0
 31 33  1  0  0  0  0
 32 33  2  0  0  0  0
M  END
>  <Mol_ID> (115)
7227

>  <Formula> (115)
C29H42Cl2N2O4

>  <MolWeight> (115)
553.56078

>  <Cat> (115)
S3239

>  <Name> (115)
Emetine Dihydrochloride

>  <Target> (115)
HIF

>  <Form> (115)
Dihydrochloride

>  <CAS> (115)
316-42-7

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

$$$$

csChFnd80/10262011462D

 38 45  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 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2704    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4828    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4828    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2704    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2704    5.5951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0580    6.2951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    5.5951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    6.2951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    5.5951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    7.6951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    8.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    7.6951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    6.2951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0580    7.6951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    8.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4828    6.2951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4828    7.6951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2704    8.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    9.7903    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2704    9.7903    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6911    5.5976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6911    4.1927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2704    0.0000    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
    0.0000    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    5.5976    0.0000 C   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
    4.8455    9.7903    0.0000 O   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
  6  1  2  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
  8 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14  9  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 10  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19  6  1  0  0  0  0
 18 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 19  2  0  0  0  0
 16 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 20  1  0  0  0  0
 15 26  2  0  0  0  0
 26 27  1  0  0  0  0
 27 28  2  0  0  0  0
 28 24  1  0  0  0  0
 21 29  1  0  0  0  0
 28 30  1  0  0  0  0
 26 31  1  0  0  0  0
 13 32  1  0  0  0  0
 11 33  1  0  0  0  0
  3 34  1  0  0  0  0
  1 35  1  0  0  0  0
 23 36  1  0  0  0  0
  7 37  2  0  0  0  0
 25 38  2  0  0  0  0
M  END
>  <Mol_ID> (116)
7256

>  <Formula> (116)
C30H16O8

>  <MolWeight> (116)
504.44324

>  <Cat> (116)
S3273

>  <Name> (116)
Hypericin

>  <Target> (116)
MAO

>  <Form> (116)
free base

>  <CAS> (116)
548-04-9

>  <URL> (116)
http://www.selleckchem.com/products/hypericin.html

$$$$

csChFnd80/10262011462D

 26 29  0  0  0  0  0  0  0  0999 V2000
    7.3666    2.8483    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9418    0.0484    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8528    7.0576    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.8821    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0147    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3666    0.0484    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0792    9.2111    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7295    2.1483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7295    0.7484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9418    2.8483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1541    2.1483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4781    2.8968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3666    4.2482    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3666    7.0480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5789    6.3480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4781    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2097    2.1776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2097    0.7193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5789    4.9481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1541    0.7484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1541    4.9481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1541    6.3480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3441    8.5061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6013    9.2449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8640    8.5158    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0053    4.2820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 11  1  0  0  0  0
  1 13  1  0  0  0  0
  2  9  1  0  0  0  0
  2 20  1  0  0  0  0
  3 15  1  0  0  0  0
  3 25  1  0  0  0  0
  4 17  1  0  0  0  0
  4 26  1  0  0  0  0
  5 18  1  0  0  0  0
  6 20  2  0  0  0  0
  7 25  2  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 12  2  0  0  0  0
  9 16  2  0  0  0  0
 10 11  2  0  0  0  0
 11 20  1  0  0  0  0
 12 17  1  0  0  0  0
 13 19  2  0  0  0  0
 13 21  1  0  0  0  0
 14 15  2  0  0  0  0
 14 22  1  0  0  0  0
 14 23  1  0  0  0  0
 15 19  1  0  0  0  0
 16 18  1  0  0  0  0
 17 18  2  0  0  0  0
 21 22  2  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (117)
7270

>  <Formula> (117)
C19H12O7

>  <MolWeight> (117)
352.29438

>  <Cat> (117)
S3289

>  <Name> (117)
Daphnoretin

>  <Target> (117)
PKC

>  <Form> (117)
free base

>  <CAS> (117)
2034-69-7

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

$$$$
