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>  <Mol_ID> (1)
13

>  <Formula> (1)
C53H84NO14P

>  <MolWeight> (1)
990.206121

>  <Cat> (1)
S1022

>  <Name> (1)
Deforolimus (MK-8669) 

>  <Synonyms> (1)
AP23573, MK-8669

>  <Target> (1)
mTOR

>  <Form> (1)
Free Base

>  <CAS> (1)
572924-54-0

>  <URL> (1)
http://www.selleckchem.com/products/Deforolimus.html

$$$$
1.cdx
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M  END
>  <Mol_ID> (2)
26

>  <Formula> (2)
C19H16N4O3

>  <MolWeight> (2)
348.35534

>  <Cat> (2)
S1038

>  <Name> (2)
PI-103

>  <Synonyms> (2)
N/A

>  <Target> (2)
DNA-PK, PI3K, mTOR

>  <Form> (2)
Free Base

>  <CAS> (2)
371935-74-9

>  <URL> (2)
http://www.selleckchem.com/products/PI-103.html

$$$$
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Rapamycin (Sirolimus)

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mTOR 

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53123-88-9

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

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>  <Mol_ID> (4)
41

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C23H27N7O3S2

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RG7321

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PI3K 

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957054-30-7

>  <URL> (4)
http://www.selleckchem.com/products/GDC-0941.html

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475110-96-4

>  <URL> (5)
http://www.selleckchem.com/products/ZSTK474.html

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GSK-3 

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280744-09-4

>  <URL> (6)
http://www.selleckchem.com/products/SB-216763.html

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M  END
>  <Mol_ID> (7)
46

>  <Formula> (7)
C21H16FN3OS

>  <MolWeight> (7)
377.4346432

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S1076

>  <Name> (7)
SB 203580

>  <Synonyms> (7)
N/A

>  <Target> (7)
p38 MAPK 

>  <Form> (7)
Free Base

>  <CAS> (7)
152121-47-6

>  <URL> (7)
http://www.selleckchem.com/products/SB-203580.html

$$$$

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>  <Mol_ID> (8)
48

>  <Formula> (8)
C25H23Cl2N5O

>  <MolWeight> (8)
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>  <Cat> (8)
S1078

>  <Name> (8)
MK-2206 dihydrochloride

>  <Synonyms> (8)
N/A

>  <Target> (8)
Akt

>  <Form> (8)
Dihydrochloride

>  <CAS> (8)
1032350-13-2

>  <URL> (8)
http://www.selleckchem.com/products/MK-2206.html

$$$$
untitled.cdx
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>  <Mol_ID> (9)
56

>  <Formula> (9)
C21H17NO3S2

>  <MolWeight> (9)
395.49458

>  <Cat> (9)
S1092

>  <Name> (9)
KU-55933 (ATM Kinase Inhibitor)

>  <Synonyms> (9)
N/A

>  <Target> (9)
ATM 

>  <Form> (9)
Free Base

>  <CAS> (9)
587871-26-9

>  <URL> (9)
http://www.selleckchem.com/products/KU-55933.html

$$$$
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M  END
>  <Mol_ID> (13)
74

>  <Formula> (13)
C53H83NO14

>  <MolWeight> (13)
958.22442

>  <Cat> (13)
S1120

>  <Name> (13)
Everolimus (RAD001)

>  <Synonyms> (13)
Certican, Zortress, Afinitor

>  <Target> (13)
mTOR

>  <Form> (13)
Free Base

>  <CAS> (13)
159351-69-6

>  <URL> (13)
http://www.selleckchem.com/products/Everolimus(RAD001).html

$$$$
TGX-221.cdx
csChFnd80/10232010312D

 27 30  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (14)
99

>  <Formula> (14)
C21H24N4O2

>  <MolWeight> (14)
364.44086

>  <Cat> (14)
S1169

>  <Name> (14)
TGX-221

>  <Synonyms> (14)
N/A

>  <Target> (14)
PI3K

>  <Form> (14)
Free Base

>  <CAS> (14)
663619-89-4

>  <URL> (14)
http://www.selleckchem.com/products/TGX-221.html

$$$$
Adriamycin (Doxorubicin Hydrochloride).cdx
csChFnd80/10232010312D

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M  END
>  <Mol_ID> (15)
126

>  <Formula> (15)
C27H30ClNO11

>  <MolWeight> (15)
579.9802

>  <Cat> (15)
S1208

>  <Name> (15)
Doxorubicin (Adriamycin) HCl

>  <Synonyms> (15)
N/A 

>  <Target> (15)
Topoisomerase

>  <Form> (15)
Hydrochloride

>  <CAS> (15)
25316-40-9

>  <URL> (15)
http://www.selleckchem.com/products/Adriamycin.html

$$$$
KU-0063794.cdx
csChFnd80/10232010312D

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M  END
>  <Mol_ID> (16)
136

>  <Formula> (16)
C25H31N5O4

>  <MolWeight> (16)
465.54474

>  <Cat> (16)
S1226

>  <Name> (16)
Ku-0063794

>  <Synonyms> (16)
N/A

>  <Target> (16)
mTOR 

>  <Form> (16)
Free Base

>  <CAS> (16)
938440-64-3

>  <URL> (16)
http://www.selleckchem.com/products/KU-0063794.html

$$$$
WYE-354.cdx
csChFnd80/10232010312D

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mTOR 

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1062169-56-5

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http://www.selleckchem.com/products/WYE-354.html

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PLK

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1225497-78-8

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>  <Mol_ID> (25)
341

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C20H31N3O2S2

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>  <Synonyms> (25)
N/A 

>  <Target> (25)
Akt, PDK-1

>  <Form> (25)
Free Base

>  <CAS> (25)
1191951-57-1

>  <URL> (25)
http://www.selleckchem.com/products/PHT-427.html

$$$$
AT7867.cdx
csChFnd80/10232010312D

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>  <Mol_ID> (26)
344

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C20H20ClN3

>  <MolWeight> (26)
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S1558

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AT7867

>  <Synonyms> (26)
N/A

>  <Target> (26)
Akt, S6 kinase

>  <Form> (26)
Free Base

>  <CAS> (26)
857531-00-1

>  <URL> (26)
http://www.selleckchem.com/products/AT7867.html

$$$$
KU-60019.cdx
csChFnd80/10232010312D

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>  <Mol_ID> (27)
350

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C30H33N3O5S

>  <MolWeight> (27)
547.66512

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S1570

>  <Name> (27)
KU-60019

>  <Synonyms> (27)
N/A

>  <Target> (27)
ATM 

>  <Form> (27)
Free Base

>  <CAS> (27)
925701-49-1

>  <URL> (27)
http://www.selleckchem.com/products/KU-60019.html

$$$$
ALINIA (nitazoxanide).cdx
csChFnd80/10232010312D

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>  <Mol_ID> (28)
377

>  <Formula> (28)
C12H9N3O5S

>  <MolWeight> (28)
307.28196

>  <Cat> (28)
S1627

>  <Name> (28)
Nitazoxanide (Alinia, Annita)

>  <Synonyms> (28)
Daxon, Dexidex, Kidonax, Pacovanton, Paramix, Nitax, Zox, Nitazox, Toza

>  <Target> (28)
Others

>  <Form> (28)
Free Base

>  <CAS> (28)
55981-09-4

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

$$$$
Artemisinin.cdx
csChFnd80/10232010312D

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>  <Mol_ID> (29)
390

>  <Formula> (29)
C15H22O5

>  <MolWeight> (29)
282.33218

>  <Cat> (29)
S1282

>  <Name> (29)
Artemisinin

>  <Synonyms> (29)
Qinghaosu

>  <Target> (29)
Antifection

>  <Form> (29)
Free Base

>  <CAS> (29)
63968-64-9

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

$$$$
clemastine fumarate.cdx
csChFnd80/10232010312D

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Clemastine Fumarate

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Tavist, Agasten 

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Histamine Receptor

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Fumarate

>  <CAS> (30)
14976-57-9

>  <URL> (30)
http://www.selleckchem.com/products/Clemastine-Fumarate.html

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Metformin hydrochloride.cdx
csChFnd80/10232010312D

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486

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S1950

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Metformin hydrochloride (Glucophage)

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Glucophage, Riomet, Diabex

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Hydrochloride

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1115-70-4

>  <URL> (31)
http://www.selleckchem.com/products/Metformin-hydrochloride(Glucophage).html

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Indirubin.cdx
csChFnd80/10232010312D

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527

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C16H10N2O2

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262.2628

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Indirubin

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N/A

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GSK-3

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Free Base

>  <CAS> (32)
479-41-4 

>  <URL> (32)
http://www.selleckchem.com/products/Indirubin.html

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CHIR-98014.cdx
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550

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CHIR-98014

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N/A

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GSK-3

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Free Base

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252935-94-7

>  <URL> (33)
http://www.selleckchem.com/products/chir-98014.html

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>  <Mol_ID> (34)
555

>  <Formula> (34)
C32H29F3N6O6

>  <MolWeight> (34)
650.6044696

>  <Cat> (34)
S2749

>  <Name> (34)
NVP-BGT226

>  <Synonyms> (34)
N/A 

>  <Target> (34)
PI3K, mTOR

>  <Form> (34)
Maleate

>  <CAS> (34)
1245537-68-1

>  <URL> (34)
http://www.selleckchem.com/products/nvp-bgt226.html

$$$$
YM201636.cdx
csChFnd80/10232010312D

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M  END
>  <Mol_ID> (35)
557

>  <Formula> (35)
C25H21N7O3

>  <MolWeight> (35)
467.47934

>  <Cat> (35)
S1219

>  <Name> (35)
YM201636

>  <Synonyms> (35)
N/A

>  <Target> (35)
PI3K 

>  <Form> (35)
Free Base

>  <CAS> (35)
371942-69-7

>  <URL> (35)
http://www.selleckchem.com/products/ym201636.html

$$$$
3-Methyladenine.cdx
csChFnd80/10232010312D

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M  END
>  <Mol_ID> (36)
562

>  <Formula> (36)
C6H7N5

>  <MolWeight> (36)
149.15328

>  <Cat> (36)
S2767

>  <Name> (36)
3-Methyladenine (3-MA)

>  <Synonyms> (36)
3-MA

>  <Target> (36)
PI3K

>  <Form> (36)
Free Base

>  <CAS> (36)
5142-23-4

>  <URL> (36)
http://www.selleckchem.com/products/3-methyladenine.html

$$$$
BX-795.cdx
csChFnd80/10232010312D

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M  END
>  <Mol_ID> (37)
564

>  <Formula> (37)
C23H26IN7O2S

>  <MolWeight> (37)
591.46771

>  <Cat> (37)
S1274

>  <Name> (37)
BX-795

>  <Synonyms> (37)
N/A

>  <Target> (37)
PDK-1, IKK

>  <Form> (37)
Free Base

>  <CAS> (37)
702675-74-9

>  <URL> (37)
http://www.selleckchem.com/products/bx-795.html

$$$$
BX-912.cdx
csChFnd80/10232010312D

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>  <Mol_ID> (38)
565

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>  <Target> (38)
PDK-1 

>  <Form> (38)
Free Base

>  <CAS> (38)
702674-56-4

>  <URL> (38)
http://www.selleckchem.com/products/bx-912.html

$$$$
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csChFnd80/10232010312D

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$$$$
BYL-719.cdx
csChFnd80/10232010312D

 30 32  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (43)
618

>  <Formula> (43)
C19H22F3N5O2S

>  <MolWeight> (43)
441.4704896

>  <Cat> (43)
S2814

>  <Name> (43)
Alpelisib (BYL719)

>  <Synonyms> (43)
N/A 

>  <Target> (43)
PI3K

>  <Form> (43)
Free Base

>  <CAS> (43)
1217486-61-7

>  <URL> (43)
http://www.selleckchem.com/products/byl719.html

$$$$
Quercetin.cdx
csChFnd80/10232010312D

 22 24  0  0  0  0  0  0  0  0999 V2000
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 10  5  1  0  0  0  0
  1 11  1  0  0  0  0
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M  END
>  <Mol_ID> (44)
625

>  <Formula> (44)
C15H10O7

>  <MolWeight> (44)
302.2357

>  <Cat> (44)
S2391

>  <Name> (44)
Quercetin (Sophoretin)

>  <Synonyms> (44)
Meletin, Quercetine

>  <Target> (44)
PI3K, PKC, Src, Sirtuin

>  <Form> (44)
Free Base

>  <CAS> (44)
117-39-5

>  <URL> (44)
http://www.selleckchem.com/products/Quercetin(Sophoretin).html

$$$$
Salidroside.cdx
csChFnd80/10232010312D

 21 22  0  0  0  0  0  0  0  0999 V2000
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  7 21  1  0  0  0  0
M  END
>  <Mol_ID> (45)
629

>  <Formula> (45)
C14H20O7

>  <MolWeight> (45)
300.3044

>  <Cat> (45)
S2396

>  <Name> (45)
Salidroside (Rhodioloside)

>  <Synonyms> (45)
Rhodioloside

>  <Target> (45)
Others

>  <Form> (45)
Free Base

>  <CAS> (45)
10338-51-9

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

$$$$
PIK 293.cdx
csChFnd80/10232010312D

 30 34  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (46)
681

>  <Formula> (46)
C22H19N7O

>  <MolWeight> (46)
397.43256

>  <Cat> (46)
S2207

>  <Name> (46)
PIK-293

>  <Synonyms> (46)
N/A

>  <Target> (46)
PI3K

>  <Form> (46)
Free Base

>  <CAS> (46)
900185-01-5 

>  <URL> (46)
http://www.selleckchem.com/products/PIK-293.html

$$$$
PP442.cdx
csChFnd80/10232010312D

 23 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (47)
687

>  <Formula> (47)
C16H16N6O

>  <MolWeight> (47)
308.33784

>  <Cat> (47)
S2218

>  <Name> (47)
Torkinib (PP242)

>  <Synonyms> (47)
TORKinib 

>  <Target> (47)
mTOR

>  <Form> (47)
Free Base

>  <CAS> (47)
1092351-67-1

>  <URL> (47)
http://www.selleckchem.com/products/PP242.html

$$$$
(+)-Usniacin.cdx
csChFnd80/10232010312D

 25 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (48)
691

>  <Formula> (48)
C18H16O7

>  <MolWeight> (48)
344.31544

>  <Cat> (48)
S2252

>  <Name> (48)
(+)-Usniacin (D-Usnic acid)

>  <Synonyms> (48)
D-Usnic acid

>  <Target> (48)
Others

>  <Form> (48)
Free Base

>  <CAS> (48)
7562-61-0

>  <URL> (48)
http://www.selleckchem.com/products/(+)-Usniacin(D-Usnic-acid).html

$$$$
Apigenin.cdx
csChFnd80/10232010312D

 20 22  0  0  0  0  0  0  0  0999 V2000
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 10  4  1  0  0  0  0
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M  END
>  <Mol_ID> (49)
697

>  <Formula> (49)
C15H10O5

>  <MolWeight> (49)
270.2369

>  <Cat> (49)
S2262

>  <Name> (49)
Apigenin

>  <Synonyms> (49)
N/A

>  <Target> (49)
P450

>  <Form> (49)
Free Base

>  <CAS> (49)
520-36-5

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

$$$$
Honokiol.cdx
csChFnd80/10232010312D

 20 21  0  0  0  0  0  0  0  0999 V2000
    2.0951    3.6289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (50)
733

>  <Formula> (50)
C18H18O2

>  <MolWeight> (50)
266.33432

>  <Cat> (50)
S2310

>  <Name> (50)
Honokiol

>  <Synonyms> (50)
N/A

>  <Target> (50)
Akt, MEK

>  <Form> (50)
Free Base

>  <CAS> (50)
35354-74-6

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

$$$$
Myricetin.cdx
csChFnd80/10232010312D

 23 25  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
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M  END
>  <Mol_ID> (51)
745

>  <Formula> (51)
C15H10O8

>  <MolWeight> (51)
318.2351

>  <Cat> (51)
S2326

>  <Name> (51)
Myricetin (Cannabiscetin)

>  <Synonyms> (51)
Cannabiscetin, Myricetol, Myricitin

>  <Target> (51)
NULL

>  <Form> (51)
Free Base

>  <CAS> (51)
529-44-2

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

$$$$
Oridonin.cdx
csChFnd80/10232010312D

 28 32  0  0  0  0  0  0  0  0999 V2000
    2.5553    2.8000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (52)
752

>  <Formula> (52)
C20H28O6

>  <MolWeight> (52)
364.43272

>  <Cat> (52)
S2335

>  <Name> (52)
Oridonin (Isodonol)

>  <Synonyms> (52)
Isodonol

>  <Target> (52)
Others

>  <Form> (52)
Free Base

>  <CAS> (52)
28957-04-2

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

$$$$
Quercetin dihydrate.cdx
csChFnd80/10232010312D

 24 24  0  0  0  0  0  0  0  0999 V2000
    1.2082    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0580    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0580    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    4.1951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.1927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    1.3976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4786    3.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6911    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6911    5.5927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4786    6.2927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    5.5927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4786    7.6879    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8993    6.2903    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1496    3.8440    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7497    3.8440    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  1 11  1  0  0  0  0
  3 12  1  0  0  0  0
  7 13  2  0  0  0  0
  8 14  1  0  0  0  0
  9 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 15  1  0  0  0  0
 19 21  1  0  0  0  0
 18 22  1  0  0  0  0
M  END
>  <Mol_ID> (53)
762

>  <Formula> (53)
C15H14O9

>  <MolWeight> (53)
338.26626

>  <Cat> (53)
S2347

>  <Name> (53)
Quercetin dihydrate (Sophoretin)

>  <Synonyms> (53)
Sophoretin, Meletin, Quercetine, Xanthaurine, Quercetol, Quercitin 

>  <Target> (53)
Others

>  <Form> (53)
Dihydrate

>  <CAS> (53)
6151-25-3

>  <URL> (53)
http://www.selleckchem.com/products/Quercetin-dihydrate(Sophoretin).html

$$$$
Dihydromyricetin.cdx
csChFnd80/10232010312D

 23 25  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  1  0  0  0  0  0  0  0  0  0
    6.0580    3.4951    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.8455    4.1951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.1927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    1.3976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4786    3.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6911    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6911    5.5927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4786    6.2927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    5.5927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4786    7.6879    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8993    6.2903    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8993    3.4951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  1 11  1  0  0  0  0
  3 12  1  0  0  0  0
  7 13  2  0  0  0  0
  8 14  1  1  0  0  0
  9 15  1  6  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 15  1  0  0  0  0
 19 21  1  0  0  0  0
 18 22  1  0  0  0  0
 17 23  1  0  0  0  0
M  END
>  <Mol_ID> (54)
767

>  <Formula> (54)
C15H12O8

>  <MolWeight> (54)
320.25098

>  <Cat> (54)
S2399

>  <Name> (54)
Dihydromyricetin (Ampeloptin)

>  <Synonyms> (54)
Ampeloptin, Ampelopsin,(+)-Ampelopsin, (+)-Dihydromyricetin 

>  <Target> (54)
Others

>  <Form> (54)
Free Base

>  <CAS> (54)
27200-12-0

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

$$$$
Sophocarpine.cdx
csChFnd80/10232010312D

 22 25  0  0  0  0  0  0  0  0999 V2000
    0.0000    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.0951    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    3.4951    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.2124    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.0951    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.8497    3.4951    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.6373    4.1951    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.0622    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    4.1951    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    5.5951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    6.2951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    5.5951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6373    2.7951    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.8951    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.6951    0.0000 H   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  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  8 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14  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  1  0  0  0  0
  3 18  2  0  0  0  0
  5 19  1  1  0  0  0
 10 20  1  6  0  0  0
  9 21  1  6  0  0  0
  8 22  1  6  0  0  0
M  END
>  <Mol_ID> (55)
770

>  <Formula> (55)
C15H22N2O

>  <MolWeight> (55)
246.34798

>  <Cat> (55)
S2405

>  <Name> (55)
Sophocarpine

>  <Synonyms> (55)
N/A

>  <Target> (55)
Others

>  <Form> (55)
Free Base

>  <CAS> (55)
6483-15-4

>  <URL> (55)
http://www.selleckchem.com/products/Sophocarpine.html

$$$$
Chrysophanic acid.cdx
csChFnd80/10232010312D

 19 21  0  0  0  0  0  0  0  0999 V2000
    0.0000    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    4.1951    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  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
  3 15  1  0  0  0  0
 10 16  2  0  0  0  0
  7 17  2  0  0  0  0
 11 18  1  0  0  0  0
 13 19  1  0  0  0  0
M  END
>  <Mol_ID> (56)
771

>  <Formula> (56)
C15H10O4

>  <MolWeight> (56)
254.2375

>  <Cat> (56)
S2406

>  <Name> (56)
Chrysophanic acid (Chrysophanol)

>  <Synonyms> (56)
Chrysophanol, NSC 37132, NSC 646567

>  <Target> (56)
EGFR, mTOR

>  <Form> (56)
Free Base

>  <CAS> (56)
481-74-3

>  <URL> (56)
http://www.selleckchem.com/products/Chrysophanic-acid-Chrysophanol.html

$$$$
TAK-901.cdx
csChFnd80/10232010312D

 36 40  0  0  0  0  0  0  0  0999 V2000
    1.2082    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    0.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8413    2.7976    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0496    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2578    2.7976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0496    0.7049    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4702    2.0976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6827    2.7976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6827    4.1976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4702    4.8976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.4702    6.2927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6827    6.9927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.4702    9.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.1033    9.7903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1933   10.2985    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5884    7.8821    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3115    9.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0141    2.3649    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.8370    3.4976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0141    4.6302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2294    3.6439    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.7988    4.9229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9759    6.0555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5836    5.9092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5433    7.3300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  1  1  0  0  0  0
  2  7  1  0  0  0  0
  5  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  2  0  0  0  0
 10 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
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 16 10  1  0  0  0  0
 12 17  1  0  0  0  0
 15 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
 24 25  1  0  0  0  0
 24 26  2  0  0  0  0
 24 27  2  0  0  0  0
 25 28  1  0  0  0  0
 13 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 31 14  1  0  0  0  0
 30 32  1  0  0  0  0
 32 33  2  0  0  0  0
 33 34  1  0  0  0  0
 34 35  2  0  0  0  0
 35 31  1  0  0  0  0
 34 36  1  0  0  0  0
M  END
>  <Mol_ID> (57)
796

>  <Formula> (57)
C28H32N4O3S

>  <MolWeight> (57)
504.64368

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1092788-83-4

>  <URL> (63)
http://www.selleckchem.com/products/PP121.html

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PI3K

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Free Base

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944396-07-0

>  <URL> (64)
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885499-61-6

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501437-28-1

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130964-39-5

>  <URL> (88)
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M  END
>  <Mol_ID> (89)
1256

>  <Formula> (89)
C9H14N4O5

>  <MolWeight> (89)
258.23126

>  <Cat> (89)
S1802

>  <Name> (89)
AICAR (Acadesine)

>  <Synonyms> (89)
AICAR, AICA-riboside

>  <Target> (89)
AMPK

>  <Form> (89)
Free Base

>  <CAS> (89)
2627-69-2

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

$$$$
PF-04708671.cdx
csChFnd80/10232010312D

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M  END
>  <Mol_ID> (90)
1260

>  <Formula> (90)
C19H21F3N6

>  <MolWeight> (90)
390.4054496

>  <Cat> (90)
S2163

>  <Name> (90)
PF-4708671

>  <Synonyms> (90)
PF-04708671

>  <Target> (90)
S6 Kinase

>  <Form> (90)
Free Base

>  <CAS> (90)
1255517-76-0

>  <URL> (90)
http://www.selleckchem.com/products/pf-4708671.html

$$$$
untitled.cdx
csChFnd80/10232010312D

 23 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (91)
1463

>  <Formula> (91)
C13H16N6O4

>  <MolWeight> (91)
320.30394

>  <Cat> (91)
S1117

>  <Name> (91)
Triciribine

>  <Synonyms> (91)
N/A

>  <Target> (91)
Akt

>  <Form> (91)
Free Base

>  <CAS> (91)
35943-35-2

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

$$$$
Flufenamic acid.cdx
csChFnd80/10232010312D

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M  END
>  <Mol_ID> (92)
1489

>  <Formula> (92)
C14H10F3NO2

>  <MolWeight> (92)
281.2299096

>  <Cat> (92)
S4268

>  <Name> (92)
Flufenamic acid

>  <Synonyms> (92)
N/A

>  <Target> (92)
COX

>  <Form> (92)
Free Base

>  <CAS> (92)
530-78-9

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

$$$$
PROGRAF (tacrolimus).cdx
csChFnd80/10232010312D

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>  <Mol_ID> (93)
1534

>  <Formula> (93)
C44H69NO12

>  <MolWeight> (93)
804.01816

>  <Cat> (93)
S5003

>  <Name> (93)
Tacrolimus (FK506)

>  <Synonyms> (93)
FR900506

>  <Target> (93)
mTOR

>  <Form> (93)
Free Base

>  <CAS> (93)
104987-11-3

>  <URL> (93)
http://www.selleckchem.com/products/FK-506-(Tacrolimus).html

$$$$
Temsirolimus.cdx
csChFnd80/10232010312D

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>  <Mol_ID> (94)
1537

>  <Formula> (94)
C56H87NO16

>  <MolWeight> (94)
1030.28708

>  <Cat> (94)
S1044

>  <Name> (94)
Temsirolimus (CCI-779, NSC 683864)

>  <Synonyms> (94)
N/A

>  <Target> (94)
mTOR

>  <Form> (94)
Free Base

>  <CAS> (94)
162635-04-3

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

$$$$
Danthron.cdx
csChFnd80/10232010312D

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>  <Mol_ID> (95)
1594

>  <Formula> (95)
C14H8O4

>  <MolWeight> (95)
240.21092

>  <Cat> (95)
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>  <Name> (95)
Danthron

>  <Synonyms> (95)
chrysazin, Antrapurol

>  <Target> (95)
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>  <Form> (95)
Free Base

>  <CAS> (95)
117-10-2

>  <URL> (95)
http://www.selleckchem.com/products/danthron.html

$$$$
S4711 Esculetin.cdx
csChFnd80/10232010312D

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>  <Mol_ID> (96)
1702

>  <Formula> (96)
C9H6O4

>  <MolWeight> (96)
178.14154

>  <Cat> (96)
S4711

>  <Name> (96)
Esculetin

>  <Synonyms> (96)
Cichorigenin|Aesculetin

>  <Target> (96)
Others

>  <Form> (96)
Free Base

>  <CAS> (96)
305-01-1

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

$$$$
S3940 3'-Hydroxypterostilbene.cdx
csChFnd80/10232010312D

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    9.6900    8.4134    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  2  3  2  0  0  0  0
  2  7  1  0  0  0  0
  3  4  1  0  0  0  0
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  4 20  1  0  0  0  0
  5  6  1  0  0  0  0
  5 19  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
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  9 14  2  0  0  0  0
 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
 13 15  1  0  0  0  0
 15 16  1  0  0  0  0
 17 18  1  0  0  0  0
M  END
>  <Mol_ID> (97)
1878

>  <Formula> (97)
C16H16O4

>  <MolWeight> (97)
272.29584

>  <Cat> (97)
S3940

>  <Name> (97)
3'-Hydroxypterostilbene

>  <Synonyms> (97)
3'-HPT

>  <Target> (97)
Others

>  <Form> (97)
free base

>  <CAS> (97)
475231-21-1

>  <URL> (97)
http://www.selleckchem.com/products/3-hydroxypterostilbene.html

$$$$
S3984 Nordihydroguaiaretic acid.cdx
csChFnd80/10232010312D

 22 23  0  0  0  0  0  0  0  0999 V2000
    8.5458    2.8429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3334    2.1429    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.1209    2.8429    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.9085    2.1429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1209    4.2429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3334    0.7429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6961    2.8429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3627    2.0803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.7935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2298    4.2027    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5137    4.8860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6909    4.1191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0173    4.9027    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.0935    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9749    2.8453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2155    2.0977    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1617    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.7583    0.7460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3742    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  3  5  1  0  0  0  0
  2  6  1  0  0  0  0
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 10 11  2  0  0  0  0
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 10 13  1  0  0  0  0
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  4  7  1  0  0  0  0
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 15 20  2  0  0  0  0
 18 21  1  0  0  0  0
 17 22  1  0  0  0  0
  1 15  1  0  0  0  0
M  END
>  <Mol_ID> (98)
1883

>  <Formula> (98)
C18H22O4

>  <MolWeight> (98)
302.36488

>  <Cat> (98)
S3984

>  <Name> (98)
Nordihydroguaiaretic acid

>  <Synonyms> (98)
N/A

>  <Target> (98)
lipoxygenase

>  <Form> (98)
free base

>  <CAS> (98)
500-38-9

>  <URL> (98)
http://www.selleckchem.com/products/nordihydroguaiaretic-acid.html

$$$$
S3839 1-Deoxynojirimycin.cdx
csChFnd80/10232010312D

 11 11  0  0  0  0  0  0  0  0999 V2000
    2.1100    3.6488    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.4000    2.4422    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.5066    3.6392    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4100    4.8613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    2.4422    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1999    2.4229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0135    4.8613    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4899    1.2124    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.3900    0.0116    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1899    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  1  0  0  0
  2  5  1  0  0  0  0
  2  6  1  6  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  5 10  1  1  0  0  0
  7  9  1  0  0  0  0
  9 11  1  6  0  0  0
M  END
>  <Mol_ID> (99)
1888

>  <Formula> (99)
C6H13NO4

>  <MolWeight> (99)
163.17172

>  <Cat> (99)
S3839

>  <Name> (99)
1-Deoxynojirimycin

>  <Synonyms> (99)
duvoglustat, moranolin

>  <Target> (99)
¦Á-glucosidase

>  <Form> (99)
free base

>  <CAS> (99)
19130-96-2

>  <URL> (99)
http://www.selleckchem.com/products/1-deoxynojirimycin.html

$$$$
S3836 6-Gingerol.cdx
csChFnd80/10232010312D

 21 21  0  0  0  0  0  0  0  0999 V2000
    4.8540    4.8939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0665    4.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2789    4.8939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9162    4.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1287    4.8939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3411    4.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5535    4.8939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7660    4.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2789    6.2939    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6416    4.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    2.0921    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
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  9 10  1  0  0  0  0
  3 11  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 12 17  2  0  0  0  0
 18 19  1  0  0  0  0
 14 18  1  0  0  0  0
 15 20  1  0  0  0  0
  1 12  1  0  0  0  0
  5 21  1  1  0  0  0
M  END
>  <Mol_ID> (100)
1905

>  <Formula> (100)
C17H26O4

>  <MolWeight> (100)
294.38594

>  <Cat> (100)
S3836

>  <Name> (100)
6-Gingerol

>  <Synonyms> (100)
CI-1011

>  <Target> (100)
CYP2C9,ACAT,CYP1A2,CYP2C19

>  <Form> (100)
free base

>  <CAS> (100)
23513-14-6

>  <URL> (100)
http://www.selleckchem.com/products/Avasimibe(CI-1011).html

$$$$
S3781 Ginkgolide C.cdx
csChFnd80/10232010312D

 32 37  0  0  0  0  0  0  0  0999 V2000
    6.0576    3.5342    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
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    3.6325    4.9289    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
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    4.8359    2.8234    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.0574    4.9185    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.2654    5.6136    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    8.4490    3.5006    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   10.8595    3.4670    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
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 11  1  1  0  0  0  0
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  2  3  1  0  0  0  0
  3  6  1  0  0  0  0
  4 20  1  1  0  0  0
  5  4  1  0  0  0  0
  5  8  1  0  0  0  0
  5 21  1  1  0  0  0
  5  6  1  0  0  0  0
  6 22  1  1  0  0  0
  6  7  1  0  0  0  0
  7 25  1  1  0  0  0
  8 18  1  1  0  0  0
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 10  9  1  0  0  0  0
 10 11  1  0  0  0  0
 14 10  1  0  0  0  0
 11 16  1  0  0  0  0
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 13 24  2  0  0  0  0
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 15 17  1  0  0  0  0
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 17 29  1  6  0  0  0
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 18 28  2  0  0  0  0
 27 30  1  0  0  0  0
 27 31  1  0  0  0  0
 27 32  1  0  0  0  0
M  END
>  <Mol_ID> (101)
1982

>  <Formula> (101)
C20H24O11

>  <MolWeight> (101)
440.39796

>  <Cat> (101)
S3781

>  <Name> (101)
Ginkgolide C

>  <Synonyms> (101)
BN-52022

>  <Target> (101)
Others

>  <Form> (101)
free base

>  <CAS> (101)
15291-76-6

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

$$$$
Torin 1.cdx
csChFnd80/10232010312D

 45 51  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (102)
2008

>  <Formula> (102)
C35H28F3N5O2

>  <MolWeight> (102)
607.6243296

>  <Cat> (102)
S2827

>  <Name> (102)
Torin 1

>  <Synonyms> (102)
N/A 

>  <Target> (102)
mTOR

>  <Form> (102)
Free Base

>  <CAS> (102)
1222998-36-8

>  <URL> (102)
http://www.selleckchem.com/products/torin-1.html

$$$$
TG 100713.cdx
csChFnd80/10232010312D

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M  END
>  <Mol_ID> (103)
2013

>  <Formula> (103)
C12H10N6O

>  <MolWeight> (103)
254.2474

>  <Cat> (103)
S2870

>  <Name> (103)
TG 100713

>  <Synonyms> (103)
N/A

>  <Target> (103)
PI3K

>  <Form> (103)
Free Base

>  <CAS> (103)
925705-73-3

>  <URL> (103)
http://www.selleckchem.com/products/tg-100713.html

$$$$
CGK 733.cdx
csChFnd80/10232010312D

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M  END
>  <Mol_ID> (104)
2030

>  <Formula> (104)
C23H18Cl3FN4O3S

>  <MolWeight> (104)
555.8364232

>  <Cat> (104)
S7136

>  <Name> (104)
CGK 733

>  <Synonyms> (104)
N/A

>  <Target> (104)
ATM/ATR

>  <Form> (104)
Free Base

>  <CAS> (104)
905973-89-9

>  <URL> (104)
http://www.selleckchem.com/products/cgk-733.html

$$$$
Chloroquine phosphate.cdx
csChFnd80/10232010312D

 32 31  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (105)
2040

>  <Formula> (105)
C18H32ClN3O8P2

>  <MolWeight> (105)
515.862502

>  <Cat> (105)
S4157

>  <Name> (105)
Chloroquine Phosphate

>  <Synonyms> (105)
N/A

>  <Target> (105)
Others

>  <Form> (105)
Diphosphate

>  <CAS> (105)
50-63-5

>  <URL> (105)
http://www.selleckchem.com/products/chloroquine-phosphate.html

$$$$
S4953 Usnic acid.cdx
csChFnd80/10232010312D

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 18 24  1  0  0  0  0
 18 25  2  0  0  0  0
M  END
>  <Mol_ID> (106)
2213

>  <Formula> (106)
C18H16O7

>  <MolWeight> (106)
344.31544

>  <Cat> (106)
S4953

>  <Name> (106)
Usnic acid

>  <Synonyms> (106)
Usniacin

>  <Target> (106)
Others

>  <Form> (106)
free base

>  <CAS> (106)
125-46-2

>  <URL> (106)
http://selleckchem.com/products/usnic-acid.html

$$$$
S3832 Euphorbiasteroid.cdx
csChFnd80/10232010312D

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 29  4  1  0  0  0  0
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 20  5  1  0  0  0  0
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 14  6  1  0  0  0  0
 21  6  1  0  0  0  0
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 40 39  2  0  0  0  0
M  END
>  <Mol_ID> (107)
2216

>  <Formula> (107)
C32H40O8

>  <MolWeight> (107)
552.6552

>  <Cat> (107)
S3832

>  <Name> (107)
Euphorbiasteroid

>  <Synonyms> (107)
Euphorbia factor L1

>  <Target> (107)
Others

>  <Form> (107)
free base

>  <CAS> (107)
28649-59-4

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

$$$$
S3785 Notoginsenoside R1.cdx
csChFnd80/10232010312D

 68 74  0  0  0  0  0  0  0  0999 V2000
    6.9238    8.9622    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.0285    9.6191    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
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 48 68  1  6  0  0  0
M  END
>  <Mol_ID> (108)
2271

>  <Formula> (108)
C47H80O18

>  <MolWeight> (108)
933.1273

>  <Cat> (108)
S3785

>  <Name> (108)
Notoginsenoside R1

>  <Synonyms> (108)
Sanchinoside R1

>  <Target> (108)
Others

>  <Form> (108)
free base

>  <CAS> (108)
80418-24-2

>  <URL> (108)
http://selleckchem.com/products/notoginsenoside-r1.html

$$$$
Methyl-Hesperidin.cdx
csChFnd80/10232010312D

 44 48  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (109)
2284

>  <Formula> (109)
C29H36O15

>  <MolWeight> (109)
624.58714

>  <Cat> (109)
S2323

>  <Name> (109)
Methyl-Hesperidin

>  <Form> (109)
free base

>  <CAS> (109)
 11013-97-1

$$$$
S3810 Scutellarin.cdx
csChFnd80/10232010312D

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M  END
>  <Mol_ID> (110)
2289

>  <Formula> (110)
C21H18O12

>  <MolWeight> (110)
462.36042

>  <Cat> (110)
S3810

>  <Name> (110)
Scutellarin

>  <Synonyms> (110)
Breviscapine, Breviscapin, Scutellarein-7-glucuronide

>  <Target> (110)
Others

>  <Form> (110)
free base

>  <CAS> (110)
27740-01-8

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

$$$$
untitled.cdx
csChFnd80/10232010312D

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M  END
>  <Mol_ID> (111)
2297

>  <Formula> (111)
C21H46NO4P

>  <MolWeight> (111)
407.568001

>  <Cat> (111)
S3056

>  <Name> (111)
Miltefosine (Hexadecylphosphocholine)

>  <Synonyms> (111)
N/A

>  <Target> (111)
Akt

>  <Form> (111)
Free Base

>  <CAS> (111)
58066-85-6

>  <URL> (111)
http://www.selleckchem.com/products/miltefosine-hexadecylphosphocholine.html

$$$$
NU7026.cdx
csChFnd80/10232010312D

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 21 20  1  0  0  0  0
M  END
>  <Mol_ID> (112)
2302

>  <Formula> (112)
C17H15NO3

>  <MolWeight> (112)
281.3059

>  <Cat> (112)
S2893

>  <Name> (112)
NU7026

>  <Synonyms> (112)
N/A

>  <Target> (112)
DNA-PK

>  <Form> (112)
Free Base

>  <CAS> (112)
154447-35-5

>  <URL> (112)
http://www.selleckchem.com/products/nu7026.html

$$$$
VE-821.cdx
csChFnd80/10232010312D

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M  END
>  <Mol_ID> (117)
2370

>  <Formula> (117)
C24H32N6O3

>  <MolWeight> (117)
452.54928

>  <Cat> (117)
S8040

>  <Name> (117)
GDC-0349

>  <Synonyms> (117)
RG7603

>  <Target> (117)
mTOR

>  <Form> (117)
Free Base

>  <CAS> (117)
1207360-89-1

>  <URL> (117)
https://www.selleckchem.com/products/gdc-0349.html

$$$$
untitled.cdx
csChFnd80/10232010312D

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M  END
>  <Mol_ID> (118)
2376

>  <Formula> (118)
C21H16N6O2S2

>  <MolWeight> (118)
448.52074

>  <Cat> (118)
S1118

>  <Name> (118)
XL147 analogue

>  <Synonyms> (118)
SAR245408

>  <Target> (118)
PI3K 

>  <Form> (118)
Free Base

>  <CAS> (118)
956958-53-5

>  <URL> (118)
http://www.selleckchem.com/products/XL147.html

$$$$
PIK-75 Hydrochloride.cdx
csChFnd80/10232010312D

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M  END
>  <Mol_ID> (119)
2380

>  <Formula> (119)
C16H15BrClN5O4S

>  <MolWeight> (119)
488.7434

>  <Cat> (119)
S1205

>  <Name> (119)
PIK-75 

>  <Synonyms> (119)
N/A

>  <Target> (119)
PI3K, DNA-PK

>  <Form> (119)
Hydrochloride

>  <CAS> (119)
372196-77-5

>  <URL> (119)
http://www.selleckchem.com/products/PIK-75-Hydrochloride.html

$$$$
S1037.cdx
csChFnd80/10232010312D

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M  END
>  <Mol_ID> (120)
2385

>  <Formula> (120)
C25H52NO4P

>  <MolWeight> (120)
461.658441

>  <Cat> (120)
S1037

>  <Name> (120)
Perifosine (KRX-0401)

>  <Synonyms> (120)
NSC639966

>  <Target> (120)
Akt

>  <Form> (120)
Free Base

>  <CAS> (120)
157716-52-4

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

$$$$
bms-707035.cdx
csChFnd80/10232010312D

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>  <Mol_ID> (121)
2397

>  <Formula> (121)
C18H11N3O2S

>  <MolWeight> (121)
333.36384

>  <Cat> (121)
S1360

>  <Name> (121)
GSK1059615

>  <Synonyms> (121)
N/A

>  <Target> (121)
PI3K, mTOR

>  <Form> (121)
Free Base

>  <CAS> (121)
958852-01-2

>  <URL> (121)
http://www.selleckchem.com/products/GSK1059615.html

$$$$
PK-1587.cdx
csChFnd80/10232010312D

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 18  7  1  0  0  0  0
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 43 45  1  0  0  0  0
M  END
>  <Mol_ID> (122)
2451

>  <Formula> (122)
C32H41N9O4

>  <MolWeight> (122)
615.72584

>  <Cat> (122)
S2628

>  <Name> (122)
PF-05212384 (PKI-587)

>  <Synonyms> (122)
N/A 

>  <Target> (122)
mTOR, PI3K

>  <Form> (122)
Free Base

>  <CAS> (122)
1197160-78-3

>  <URL> (122)
http://www.selleckchem.com/products/pki587.html

$$$$
NU-7441(KU-57788).cdx
csChFnd80/10232010312D

 30 35  0  0  0  0  0  0  0  0999 V2000
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 30 25  1  0  0  0  0
M  END
>  <Mol_ID> (123)
2455

>  <Formula> (123)
C25H19NO3S

>  <MolWeight> (123)
413.48826

>  <Cat> (123)
S2638

>  <Name> (123)
NU7441(KU-57788)

>  <Synonyms> (123)
N/A 

>  <Target> (123)
DNA-PK, PI3K

>  <Form> (123)
Free Base

>  <CAS> (123)
503468-95-9 

>  <URL> (123)
http://www.selleckchem.com/products/nu7441.html

$$$$
ATP disodium salt.cdx
csChFnd80/10232010312D

 33 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (124)
2458

>  <Formula> (124)
C10H14N5Na2O13P3

>  <MolWeight> (124)
551.144683

>  <Cat> (124)
S1985

>  <Name> (124)
ATP (Adenosine-Triphosphate)

>  <Synonyms> (124)
N/A 

>  <Target> (124)
Others

>  <Form> (124)
Disodium Salt

>  <CAS> (124)
987-65-5

>  <URL> (124)
http://www.selleckchem.com/products/atp-Adenosine-Triphosphate.html

$$$$
Disodium Cromoglycate.cdx
csChFnd80/10232010312D

 36 37  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (125)
2463

>  <Formula> (125)
C23H14Na2O11

>  <MolWeight> (125)
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>  <Cat> (125)
S1911

>  <Name> (125)
Disodium Cromoglycate

>  <Synonyms> (125)
Gynazole

>  <Target> (125)
Calcium Channel

>  <Form> (125)
Disodium Salt

>  <CAS> (125)
15826-37-6

>  <URL> (125)
http://www.selleckchem.com/products/disodium-Cromoglycate.html

$$$$
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csChFnd80/10232010312D

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2510

>  <Formula> (126)
C24H25F2N3O4

>  <MolWeight> (126)
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>  <Cat> (126)
S7694

>  <Name> (126)
AZD8186

>  <Synonyms> (126)
N/A

>  <Target> (126)
Product Categories
PI3K/Akt/mTORPI3K
PI3K

>  <Form> (126)
Free Base

>  <CAS> (126)
1627494-13-6

>  <URL> (126)
http://www.selleckchem.com/products/azd8186.html

$$$$
(R)-2-Hydroxyglutarate .cdx
csChFnd80/10232010312D

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>  <Mol_ID> (127)
2526

>  <Formula> (127)
C5H6Na2O5

>  <MolWeight> (127)
192.07768

>  <Cat> (127)
S7873

>  <Name> (127)
Disodium (R)-2-Hydroxyglutarate

>  <Synonyms> (127)
N/A

>  <Target> (127)
Others

>  <Form> (127)
disodium salt

>  <CAS> (127)
103404-90-6

>  <URL> (127)
http://www.selleckchem.com/products/disodium-r-2-hydroxyglutarate.html

$$$$
GDC-0032 (RG-7604).cdx
csChFnd80/10232010312D

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>  <Mol_ID> (128)
2528

>  <Formula> (128)
C24H28N8O2

>  <MolWeight> (128)
460.53152

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S7103

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GDC-0032

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RG7604

>  <Target> (128)
PI3K

>  <Form> (128)
Free Base

>  <CAS> (128)
1282512-48-4

>  <URL> (128)
http://www.selleckchem.com/products/gdc-0032.html

$$$$
AZD6738.cdx
csChFnd80/10232010312D

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>  <Mol_ID> (129)
2543

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C20H24N6O2S

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AZD6738

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>  <Target> (129)
ATM/ATR

>  <Form> (129)
Free Base

>  <CAS> (129)
1352226-88-0

>  <URL> (129)
http://www.selleckchem.com/products/azd6738.html

$$$$
ONC201.cdx
csChFnd80/10232010312D

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Free Base

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612847-09-3

>  <URL> (131)
http://www.selleck.cn/products/akti-1-2.html

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http://www.selleck.cn/products/bio-acetoxime.html

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1608125-21-8

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BAY 1895344

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N/A

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ATR

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hydrochloride

>  <CAS> (134)
1876467-74-1(free base)

>  <URL> (134)
http://www.selleckchem.com/products/bay-1895344.html

$$$$
S3753 L-Leucine.cdx
csChFnd80/10232010312D

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C6H13NO2

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S3753

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L-Leucine

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(S)-Leucine, Leu

>  <Target> (135)
Others

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free base

>  <CAS> (135)
61-90-5

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

$$$$
GSK2334470.cdx
csChFnd80/10232010312D

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2621

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C25H34N8O

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462.59046

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S7087

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GSK2334470

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N/A

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PDK-1

>  <Form> (136)
Free Base

>  <CAS> (136)
1227911-45-6

>  <URL> (136)
http://www.selleckchem.com/products/gsk2334470.html

$$$$
TIC10.cdx
csChFnd80/10232010312D

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>  <Mol_ID> (137)
2623

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C24H26N4O

>  <MolWeight> (137)
386.48944

>  <Cat> (137)
S7127

>  <Name> (137)
TIC10 analogue

>  <Synonyms> (137)
TRAIL-inducing Compound 10

>  <Target> (137)
Akt

>  <Form> (137)
Free Base

>  <CAS> (137)
41276-02-2

>  <URL> (137)
http://www.selleckchem.com/products/tic10.html

$$$$
BIO (6-bromoindirubin-3-oxime).cdx
csChFnd80/10232010312D

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>  <Mol_ID> (138)
2625

>  <Formula> (138)
C16H10BrN3O2

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>  <Cat> (138)
S7198

>  <Name> (138)
BIO

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GSK-3 Inhibitor IX, 6-bromoindirubin-3-oxime

>  <Target> (138)
GSK-3

>  <Form> (138)
Free Base

>  <CAS> (138)
667463-62-9

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

$$$$
AZD2858.cdx
csChFnd80/10232010312D

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486424-20-8

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CZC24832

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>  <Target> (140)
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PI3K/Akt/mTORPI3K
PI3K

>  <Form> (140)
Free Base

>  <CAS> (140)
1159824-67-5

>  <URL> (140)
http://www.selleckchem.com/products/czc24832.html

$$$$
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2648

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C23H22FN3O4S

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XL388

>  <Synonyms> (141)
N/A

>  <Target> (141)
mTOR

>  <Form> (141)
Free Base

>  <CAS> (141)
1251156-08-7

>  <URL> (141)
http://www.selleckchem.com/products/xl388.html

$$$$
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>  <Mol_ID> (142)
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C24H27Cl2N5O

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>  <Cat> (142)
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>  <Name> (142)
Dorsomorphin (Compound C) 2HCl

>  <Synonyms> (142)
BML-275,Compound C

>  <Target> (142)
AMPK

>  <Form> (142)
Dihydrochloride

>  <CAS> (142)
1219168-18-9

>  <URL> (142)
http://www.selleckchem.com/products/dorsomorphin-2hcl.html

$$$$
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1232416-25-9

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M  END
>  <Mol_ID> (150)
2866

>  <Formula> (150)
C52H79N5O12

>  <MolWeight> (150)
966.20996

>  <Cat> (150)
S7091

>  <Name> (150)
Zotarolimus (ABT-578)

>  <Synonyms> (150)
N/A

>  <Target> (150)
mTOR

>  <Form> (150)
Free Base

>  <CAS> (150)
221877-54-9

>  <URL> (150)
http://www.selleckchem.com/products/zotarolimus-abt-578.html

$$$$
SF1670 (PTEN inhibitor).cdx
csChFnd80/10232010312D

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M  END
>  <Mol_ID> (151)
2872

>  <Formula> (151)
C19H17NO3

>  <MolWeight> (151)
307.34318

>  <Cat> (151)
S7310

>  <Name> (151)
SF1670 (PTEN inhibitor)

>  <Synonyms> (151)
N/A

>  <Target> (151)
PTEN

>  <Form> (151)
Free Base

>  <CAS> (151)
345630-40-2

>  <URL> (151)
http://www.selleckchem.com/products/sf1670.html

$$$$
IM-12.cdx
csChFnd80/10232010312D

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M  END
>  <Mol_ID> (152)
2873

>  <Formula> (152)
C22H20FN3O2

>  <MolWeight> (152)
377.4115032

>  <Cat> (152)
S7566

>  <Name> (152)
IM-12

>  <Synonyms> (152)
N/A

>  <Target> (152)
GSK-3

>  <Form> (152)
Free Base

>  <CAS> (152)
1129669-05-1

>  <URL> (152)
http://www.selleckchem.com/products/im-12.html

$$$$
VS-5584 (SB2343).cdx
csChFnd80/10232010312D

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>  <Mol_ID> (153)
2920

>  <Formula> (153)
C17H22N8O

>  <MolWeight> (153)
354.40958

>  <Cat> (153)
S7016

>  <Name> (153)
VS-5584 (SB2343)

>  <Synonyms> (153)
N/A

>  <Target> (153)
PI3K

>  <Form> (153)
Free Base

>  <CAS> (153)
1246560-33-7

>  <URL> (153)
http://www.selleckchem.com/products/vs-5584-sb2343.html

$$$$
Cerdulatinib (PRT-062070).cdx
csChFnd80/10232010312D

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>  <Mol_ID> (154)
2929

>  <Formula> (154)
C20H28ClN7O3S

>  <MolWeight> (154)
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>  <Cat> (154)
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>  <Name> (154)
Cerdulatinib (PRT062070, PRT2070)

>  <Synonyms> (154)
N/A

>  <Target> (154)
JAK

>  <Form> (154)
Hydrochloride

>  <CAS> (154)
1369761-01-2

>  <URL> (154)
http://www.selleckchem.com/products/cerdulatinib-prt062070-prt2070.html

$$$$
Piperlongumine.cdx
csChFnd80/10232010312D

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3053

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HTH-01-015

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N/A

>  <Target> (167)
AMPK

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Free Base

>  <CAS> (167)
1613724-42-7

>  <URL> (167)
http://www.selleckchem.com/products/hth-01-015.html

$$$$
Dorsomorphin.cdx
csChFnd80/10232010312D

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C24H25N5O

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Dorsomorphin (Compound C)

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Compound C, BML-275

>  <Target> (168)
AMPK

>  <Form> (168)
Free Base

>  <CAS> (168)
866405-64-3

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

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GSK621.cdx
csChFnd80/10232010312D

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>  <Mol_ID> (169)
3078

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C26H20ClN3O5

>  <MolWeight> (169)
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S7898

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GSK621

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N/A

>  <Target> (169)
AMPK

>  <Form> (169)
Free Base

>  <CAS> (169)
1346607-05-3

>  <URL> (169)
http://www.selleckchem.com/products/gsk621.html

$$$$
Voxtalisib (XL765, SAR245409).cdx
csChFnd80/10232010312D

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C13H14N6O

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Voxtalisib (XL765, SAR245409)

>  <Synonyms> (170)
N/A

>  <Target> (170)
PI3K

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Free Base

>  <CAS> (170)
934493-76-2

>  <URL> (170)
http://www.selleckchem.com/products/voxtalisib-xl765-sar245409.html

$$$$
LJI308.cdx
csChFnd80/10232010312D

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1627709-94-7

>  <URL> (171)
http://www.selleckchem.com/products/lji308.html

$$$$
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PI3K

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1620576-64-8

>  <URL> (185)
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csChFnd80/10232010312D

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(-)-Deguelin, (-)-cis-Deguelin

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Akt

>  <Form> (186)
Free Base

>  <CAS> (186)
522-17-8

>  <URL> (186)
http://www.selleckchem.com/products/deguelin.html

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GDC-0084.cdx
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C18H22N8O2

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PI3K

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1382979-44-3

>  <URL> (187)
http://www.selleckchem.com/products/gdc-0084.html

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>  <Target> (188)
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>  <Form> (188)
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>  <CAS> (188)
1228013-15-7

>  <URL> (188)
http://www.selleckchem.com/products/cc-115.html

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mTOR

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Free Base

>  <CAS> (189)
1429639-50-8

>  <URL> (189)
http://www.selleckchem.com/products/cz415.html

$$$$
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C19H10N2O3

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STO-609

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N/A

>  <Target> (190)
CaMK

>  <Form> (190)
Free Base

>  <CAS> (190)
52029-86-4

>  <URL> (190)
http://www.selleckchem.com/products/sto-609.html

$$$$
GSK2269557.cdx
csChFnd80/10232010312D

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>  <Mol_ID> (191)
3350

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C26H28N6O

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440.54012

>  <Cat> (191)
S7937

>  <Name> (191)
GSK2269557

>  <Synonyms> (191)
Nemiralisib

>  <Target> (191)
PI3K

>  <Form> (191)
Free Base

>  <CAS> (191)
1254036-71-9

>  <URL> (191)
http://www.selleckchem.com/products/gsk2269557.html

$$$$
ARQ 092.cdx
csChFnd80/10232010312D

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>  <Mol_ID> (192)
3362

>  <Formula> (192)
C27H25ClN6

>  <MolWeight> (192)
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>  <Cat> (192)
S8339

>  <Name> (192)
Miransertib (ARQ 092)HCl

>  <Synonyms> (192)
Miransertib

>  <Target> (192)
Akt

>  <Form> (192)
hydrochloride

>  <CAS> (192)
1313883-00-9

>  <URL> (192)
http://www.selleckchem.com/products/arq-092.html

$$$$
VPS34 inhibitor 1.cdx
csChFnd80/10232010312D

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>  <Mol_ID> (193)
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>  <Formula> (193)
C21H25N7O

>  <MolWeight> (193)
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>  <Name> (193)
VPS34 inhibitor 1 (Compound 19, PIK-III anal

>  <Synonyms> (193)
N/A

>  <Target> (193)
PI3K

>  <Form> (193)
Free Base

>  <CAS> (193)
1383716-46-8

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1879887-96-3

>  <URL> (197)
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N/A

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Raf,Src,S6 Kinase,RET V804M,RET V804L,RET wt

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free base

>  <CAS> (198)
1384071-99-1

>  <URL> (198)
http://www.selleckchem.com/products/ad80.html

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GDC-0326

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N/A

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PI3K¦Á,PI3K¦Ä,PI3K¦Ã,PI3K¦Â

>  <Form> (199)
free base

>  <CAS> (199)
1282514-88-8

>  <URL> (199)
http://www.selleckchem.com/products/gdc-0326.html#s_ref

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3-benzyl-5-((2-nitrophenoxy) methyl)-dihydrofuran-2(3H)-one

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FKBP1A

>  <Form> (200)
free base

>  <CAS> (200)
890405-51-3

>  <URL> (200)
http://www.selleckchem.com/products/3bdo.html

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1174428-47-7

>  <URL> (201)
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M  END
>  <Mol_ID> (202)
3453

>  <Formula> (202)
C30H24N8O2

>  <MolWeight> (202)
528.56396

>  <Cat> (202)
S8330

>  <Name> (202)
IPI-549

>  <Synonyms> (202)
N/A

>  <Target> (202)
PI3K¦Ã

>  <CAS> (202)
1693758-51-8

>  <URL> (202)
http://www.selleckchem.com/products/ipi-549.html

$$$$
TAK-117 (INK-1117,MLN-1117 ).cdx
csChFnd80/10232010312D

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M  END
>  <Mol_ID> (203)
3465

>  <Formula> (203)
C19H17N5O3

>  <MolWeight> (203)
363.36998

>  <Cat> (203)
S8581

>  <Name> (203)
Serabelisib (INK-1117,MLN-1117,TAK-117)

>  <Synonyms> (203)
N/A

>  <Target> (203)
PI3K¦Á 

>  <Form> (203)
Free base

>  <CAS> (203)
1268454-23-4

>  <URL> (203)
http://www.selleckchem.com/products/tak-117-ink-1117-mln-1117.html

$$$$
Autophinib.cdx
csChFnd80/10232010312D

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>  <Mol_ID> (204)
3470

>  <Formula> (204)
C14H11ClN6O3

>  <MolWeight> (204)
346.72854

>  <Cat> (204)
S8596

>  <Name> (204)
Autophinib

>  <Synonyms> (204)
N/A

>  <Target> (204)
autophagy

>  <Form> (204)
free base

>  <CAS> (204)
1644443-47-9

>  <URL> (204)
http://www.selleckchem.com/products/autophinib.html

$$$$
PF-06409577.cdx
csChFnd80/10232010312D

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M  END
>  <Mol_ID> (205)
3494

>  <Formula> (205)
C19H16ClNO3

>  <MolWeight> (205)
341.78824

>  <Cat> (205)
S8335

>  <Name> (205)
PF-06409577

>  <Synonyms> (205)
N/A

>  <Target> (205)
AMPK ¦Á2¦Â1¦Ã1,AMPK ¦Á1¦Â1¦Ã1

>  <Form> (205)
free base

>  <CAS> (205)
1467057-23-3

>  <URL> (205)
http://www.selleckchem.com/products/pf-06409577.html

$$$$
S3614 Lupeol.cdx
csChFnd80/10232010312D

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M  END
>  <Mol_ID> (206)
3523

>  <Formula> (206)
C30H50O

>  <MolWeight> (206)
426.7174

>  <Cat> (206)
S3614

>  <Name> (206)
Lupeol

>  <Synonyms> (206)
(3¦Â,13¦Î)-Lup-20(29)-en-3-ol, Clerodol, Monogynol B, Fagarasterol, Farganasterol

>  <Target> (206)
Others

>  <Form> (206)
free base

>  <CAS> (206)
545-47-1

>  <URL> (206)
http://www.selleckchem.com/products/lupeol.html

$$$$
2-D08.cdx
csChFnd80/10232010312D

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M  END
>  <Mol_ID> (207)
3608

>  <Formula> (207)
C15H10O5

>  <MolWeight> (207)
270.2369

>  <Cat> (207)
S8696

>  <Name> (207)
2-D08
2-D08

>  <Synonyms> (207)
2',3',4'-trihydroxy flavone

>  <Target> (207)
c-RET,SUMO,TAM Receptor,IL Receptor,PI3K,VEG

>  <Form> (207)
free base

>  <CAS> (207)
144707-18-6

>  <URL> (207)
http://selleckchem.com/products/2-d08.html

$$$$
Tenalisib (RP6530).cdx
csChFnd80/10232010312D

 31 35  0  0  0  0  0  0  0  0999 V2000
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  8  9  2  0  0  0  0
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 10  5  1  0  0  0  0
  7 11  2  0  0  0  0
  8 12  1  0  0  0  0
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 13 14  1  1  0  0  0
 13 15  1  0  0  0  0
 15 16  1  0  0  0  0
 14 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
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 22 17  1  0  0  0  0
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 25 19  1  0  0  0  0
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 30 12  1  0  0  0  0
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M  END
>  <Mol_ID> (208)
3685

>  <Formula> (208)
C23H18FN5O2

>  <MolWeight> (208)
415.4197232

>  <Cat> (208)
S8672

>  <Name> (208)
Tenalisib (RP6530)

>  <Synonyms> (208)
N/A

>  <Target> (208)
PI3K

>  <Form> (208)
free base

>  <CAS> (208)
1639417-53-0

>  <URL> (208)
http://selleckchem.com/products/tenalisib-rp6530.html

$$$$
Cu-CPT22.cdx
csChFnd80/10232010312D

 26 27  0  0  0  0  0  0  0  0999 V2000
    4.8355    7.0974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (209)
3715

>  <Formula> (209)
C19H22O7

>  <MolWeight> (209)
362.37378

>  <Cat> (209)
S8677

>  <Name> (209)
Cu-CPT22

>  <Synonyms> (209)
N/A

>  <Target> (209)
TLR

>  <Form> (209)
free base

>  <CAS> (209)
1416324-85-0

>  <URL> (209)
http://selleckchem.com/products/cu-cpt22.html

$$$$
S5284 Adenosine 5'-monophosphate monohydrate.cdx
csChFnd80/10232010312D

 24 25  0  0  0  0  0  0  0  0999 V2000
    6.3849    5.3916    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 13 18  1  6  0  0  0
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 20 23  2  0  0  0  0
M  END
>  <Mol_ID> (210)
3743

>  <Formula> (210)
C10H16N5O8P

>  <MolWeight> (210)
365.236501

>  <Cat> (210)
S5284

>  <Name> (210)
Adenosine 5'-monophosphate monohydrate

>  <Synonyms> (210)
5'-Adenylic acid, 5'-AMP

>  <Target> (210)
AMPK

>  <Form> (210)
hydrate 

>  <CAS> (210)
18422-05-4

>  <URL> (210)
http://selleckchem.com/products/adenosine-5-monophosphate-monohydrate.html

$$$$
S5313 SC66.cdx
csChFnd80/10232010312D

 21 23  0  0  0  0  0  0  0  0999 V2000
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    7.2746    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9119    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.1244    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    2.8000    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
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 13  8  1  0  0  0  0
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 20 21  2  0  0  0  0
 21 16  1  0  0  0  0
M  END
>  <Mol_ID> (211)
3764

>  <Formula> (211)
C18H16N2O

>  <MolWeight> (211)
276.33244

>  <Cat> (211)
S5313

>  <Name> (211)
SC66

>  <Synonyms> (211)
N/A

>  <Target> (211)
Akt

>  <Form> (211)
free base

>  <CAS> (211)
871361-88-5

>  <URL> (211)
http://selleckchem.com/products/sc66.html

$$$$
AZD1390.cdx
csChFnd80/10232010312D

 35 39  0  0  0  0  0  0  0  0999 V2000
    8.4870    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9119    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2746    4.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   13.3368    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.7465    4.9187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1451    5.5282    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.3839    2.7457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2124    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  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
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
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  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
  4 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
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 17 12  1  0  0  0  0
 15 18  1  0  0  0  0
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 20 21  2  0  0  0  0
 21 16  1  0  0  0  0
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 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 21  1  0  0  0  0
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 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
 24 29  2  0  0  0  0
 23 30  1  0  0  0  0
 11 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 11  1  0  0  0  0
M  END
>  <Mol_ID> (212)
3770

>  <Formula> (212)
C27H32FN5O2

>  <MolWeight> (212)
477.5736832

>  <Cat> (212)
S8680

>  <Name> (212)
AZD1390

>  <Synonyms> (212)
N/A

>  <Target> (212)
ATM/ATR

>  <Form> (212)
free base

>  <CAS> (212)
2089288-03-7

>  <URL> (212)
http://selleckchem.com/products/azd1390.html

$$$$
bpV (HOpic).cdx
csChFnd80/10232010312D

 18 19  0  0  0  0  0  0  0  0999 V2000
   13.5013    3.1523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5013    1.7523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7137    1.0523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9261    1.7523    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.9261    3.1523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7137    3.8523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2576    1.3197    0.0000 V   0  1  0  0  0  0  0  0  0  0  0  0
   18.0805    2.4523    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   17.2576    3.5849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5885    4.6033    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.5740    1.2170    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2973    0.8461    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.7903    0.0000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   17.8603    0.0561    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   18.6374    1.5568    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   18.5711    0.8351    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    9.7222   22.7687    0.0000 K   0  3  0  0  0  0  0  0  0  0  0  0
    0.0000   22.7687    0.0000 K   0  3  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9  5  1  0  0  0  0
  9 10  2  0  0  0  0
  2 11  1  0  0  0  0
  7 12  2  0  0  0  0
  7 13  1  0  0  0  0
  7 14  1  0  0  0  0
 13 14  1  0  0  0  0
  7 15  1  0  0  0  0
  7 16  1  0  0  0  0
 15 16  1  0  0  0  0
M  END
>  <Mol_ID> (213)
3823

>  <Formula> (213)
C6H4K2NO8V

>  <MolWeight> (213)
347.23596

>  <Cat> (213)
S8651

>  <Name> (213)
bpV (HOpic)

>  <Synonyms> (213)
Bisperoxovanadium(HOpic)

>  <Target> (213)
PTEN

>  <Form> (213)
potassium 

>  <CAS> (213)
722494-26-0

>  <URL> (213)
http://selleckchem.com/products/bpv-hopic.html

$$$$
S3792 Guggulsterone E&Z.cdx
csChFnd80/10232010312D

 26 29  0  0  0  0  0  0  0  0999 V2000
    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.4249    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.1000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.8497    2.8000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
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    7.2746    4.2000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
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    8.6061    2.3674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.0387    5.9641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 10  1  0  0  0  0
 11 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 12  1  0  0  0  0
  2 18  2  0  0  0  0
 10 19  1  6  0  0  0
 12 20  1  1  0  0  0
  9 21  1  1  0  0  0
 11 22  1  6  0  0  0
  5 23  1  1  0  0  0
 17 24  2  0  0  0  0
 24 25  1  4  0  0  0
 16 26  2  0  0  0  0
M  END
>  <Mol_ID> (214)
3831

>  <Formula> (214)
C21H28O2

>  <MolWeight> (214)
312.44582

>  <Cat> (214)
S3792

>  <Name> (214)
Guggulsterone E&Z

>  <Synonyms> (214)
N/A

>  <Target> (214)
FXR

>  <Form> (214)
free base

>  <CAS> (214)
95975-55-6

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

$$$$
S5383 Erucic acid.cdx
csChFnd80/10232010312D

 24 23  0  0  0  0  0  0  0  0999 V2000
    6.0622    2.8000    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
    7.2746    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    2.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  4  6  1  0  0  0  0
  5  7  1  0  0  0  0
  6  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
  9 11  1  0  0  0  0
 10 12  2  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 18  2  0  0  0  0
 16 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
M  END
>  <Mol_ID> (215)
3888

>  <Formula> (215)
C22H42O2

>  <MolWeight> (215)
338.56768

>  <Cat> (215)
S5383

>  <Name> (215)
Erucic acid

>  <Synonyms> (215)
cis-13-docosenoic acid

>  <Target> (215)
Others

>  <Form> (215)
free base

>  <CAS> (215)
112-86-7

>  <URL> (215)
http://selleckchem.com/products/erucic-acid.html

$$$$
S5439 5-Bromoindole.cdx
csChFnd80/10232010312D

 10 11  0  0  0  0  0  0  0  0999 V2000
    3.6292    0.6953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6346    2.0953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9590    0.2576    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4249    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9677    2.5228    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7862    1.3870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2043    0.7047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2097    2.1047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.8093    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
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  9 10  1  0  0  0  0
M  END
>  <Mol_ID> (216)
3913

>  <Formula> (216)
C8H6BrN

>  <MolWeight> (216)
196.04394

>  <Cat> (216)
S5439

>  <Name> (216)
5-Bromoindole

>  <Synonyms> (216)
N/A

>  <Target> (216)
GSK-3

>  <Form> (216)
free base

>  <CAS> (216)
10075-50-0

>  <URL> (216)
http://selleckchem.com/products/5-bromoindole.html

$$$$
S5456 Isobavachalcone.cdx
csChFnd80/10232010312D

 24 25  0  0  0  0  0  0  0  0999 V2000
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    9.7237    2.1130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5155    0.0443    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8397    3.5237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6313    1.4298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9320    1.4171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6313    4.2071    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   12.1404    2.0814    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.3613    1.3855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1404    3.4795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.5761    2.0814    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  5 10  1  0  0  0  0
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 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
 12 15  1  0  0  0  0
 14 16  2  0  0  0  0
 15 17  2  0  0  0  0
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 18 22  2  0  0  0  0
 21 23  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (217)
3923

>  <Formula> (217)
C20H20O4

>  <MolWeight> (217)
324.3704

>  <Cat> (217)
S5456

>  <Name> (217)
Isobavachalcone

>  <Synonyms> (217)
Corylifolinin

>  <Target> (217)
Anti-infection

>  <Form> (217)
free base

>  <CAS> (217)
20784-50-3

>  <URL> (217)
http://selleckchem.com/products/isobavachalcone.html

$$$$
S5265 TBB.cdx
csChFnd80/10232010312D

 13 14  0  0  0  0  0  0  0  0999 V2000
    3.6325    3.4979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6325    2.0929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4216    4.2006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4216    1.3902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2107    2.0929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2107    3.4979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7700    2.7954    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    4.9927    1.6743    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4216    5.5909    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    2.4216    0.0000    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.3902    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.2006    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  8  1  1  0  0  0  0
  4  2  1  0  0  0  0
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  6  3  2  0  0  0  0
 10  3  1  0  0  0  0
 11  4  1  0  0  0  0
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 12  5  1  0  0  0  0
 13  6  1  0  0  0  0
  7  8  2  0  0  0  0
  9  7  1  0  0  0  0
M  END
>  <Mol_ID> (218)
4031

>  <Formula> (218)
C6HBr4N3

>  <MolWeight> (218)
434.70824

>  <Cat> (218)
S5265

>  <Name> (218)
TBB

>  <Synonyms> (218)
4,5,6,7-tetrabromobenzotriazole 

>  <Target> (218)
Casein Kinase

>  <CAS> (218)
17374-26-4

>  <URL> (218)
http://selleckchem.com/products/tbb.html

$$$$
S5550 Ethyl gallate.cdx
csChFnd80/10232010312D

 14 14  0  0  0  0  0  0  0  0999 V2000
    3.6481    3.4828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4292    4.1868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6482    2.0995    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8605    4.1828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.4697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4369    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0729    3.4828    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8605    5.5826    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2201    2.0953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.1697    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4369    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0077    1.3953    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4888    3.5093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  3  6  1  0  0  0  0
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  7 12  1  0  0  0  0
  9 13  1  0  0  0  0
 12 14  1  0  0  0  0
M  END
>  <Mol_ID> (219)
4086

>  <Formula> (219)
C9H10O5

>  <MolWeight> (219)
198.1727

>  <Cat> (219)
S5550

>  <Name> (219)
Ethyl gallate

>  <Synonyms> (219)
N/A

>  <Target> (219)
NF-¦ÊB

>  <CAS> (219)
831-61-8

>  <URL> (219)
http://selleckchem.com/products/.html

$$$$
S9384 Sophocarpine Monohydrate.cdx
csChFnd80/10232010312D

 23 25  0  0  0  0  0  0  0  0999 V2000
    2.4329    2.0759    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
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    3.6508    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8656    6.2929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1 19  1  6  0  0  0
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  2  6  1  0  0  0  0
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  3  7  1  0  0  0  0
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  4  9  1  0  0  0  0
  4 10  1  0  0  0  0
  5 11  1  0  0  0  0
  5 12  1  0  0  0  0
  5 22  1  1  0  0  0
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 10 14  1  0  0  0  0
 11 15  1  0  0  0  0
 12 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 18  2  0  0  0  0
 16 17  2  0  0  0  0
M  END
>  <Mol_ID> (220)
4129

>  <Formula> (220)
C15H24N2O2

>  <MolWeight> (220)
264.36326

>  <Cat> (220)
S9384

>  <Name> (220)
Sophocarpine Monohydrate

>  <Form> (220)
free base

>  <CAS> (220)
 145572-44-7

$$$$
S9413 Yangonin.cdx
csChFnd80/10232010312D

 19 20  0  0  0  0  0  0  0  0999 V2000
    8.4874    2.7974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.7108    2.0911    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0625    2.7974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9125    2.7849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9125    4.1977    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.1250    2.0848    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
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 10 13  1  0  0  0  0
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 13 15  2  0  0  0  0
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 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (221)
4151

>  <Formula> (221)
C15H14O4

>  <MolWeight> (221)
258.26926

>  <Cat> (221)
S9413

>  <Name> (221)
Yangonin

>  <Form> (221)
free base

>  <CAS> (221)
500-62-9

$$$$
S9417 Homoplantaginin.cdx
csChFnd80/10232010312D

 33 36  0  0  0  0  0  0  0  0999 V2000
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4154

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free base

>  <CAS> (222)
17680-84-1

$$$$
S9438 Isosakuranetin.cdx
csChFnd80/10232010312D

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>  <MolWeight> (223)
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free base

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480-43-3

$$$$

csChFnd80/10232010312D

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>  <MolWeight> (224)
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>  <Cat> (224)
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>  <Synonyms> (224)
N/A

>  <Target> (224)
ATM/ATR

>  <Form> (224)
Free Base

>  <CAS> (224)
2088113-98-6

>  <URL> (224)
http://www.selleckchem.com/products/az31.html

$$$$

csChFnd80/10232010312D

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>  <MolWeight> (225)
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>  <Cat> (225)
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>  <Synonyms> (225)
N/A

>  <Target> (225)
PI3K

>  <Form> (225)
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>  <CAS> (225)
1362850-20-1

>  <URL> (225)
http://www.selleckchem.com/products/seletalisib-ucb-5857.html

$$$$

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 23 24  2  0  0  0  0
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 26 21  1  0  0  0  0
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M  END
>  <Mol_ID> (226)
4255

>  <Formula> (226)
C24H18ClN3O3

>  <MolWeight> (226)
431.87102

>  <Cat> (226)
S8654

>  <Name> (226)
ex229 (compound 991)

>  <Synonyms> (226)
N/A

>  <Target> (226)
AMPK

>  <Form> (226)
Free Base

>  <CAS> (226)
1219739-36-2

>  <URL> (226)
http://www.selleckchem.com/products/ex229-compound-991.html

$$$$

csChFnd80/10232010312D

 25 28  0  0  0  0  0  0  0  0999 V2000
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 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12  7  2  0  0  0  0
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 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 11  1  0  0  0  0
 15 16  1  0  0  0  0
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M  END
>  <Mol_ID> (227)
4263

>  <Formula> (227)
C20H16N4O

>  <MolWeight> (227)
328.36724

>  <Cat> (227)
S8729

>  <Name> (227)
AZ32

>  <Synonyms> (227)
N/A

>  <Target> (227)
ATM/ATR

>  <Form> (227)
Free Base

>  <CAS> (227)
No CAS

>  <URL> (227)
http://www.selleckchem.com/products/az32.html

$$$$

csChFnd80/10232010312D

 29 32  0  0  0  0  0  0  0  0999 V2000
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  2  8  1  0  0  0  0
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 14  9  1  0  0  0  0
  7 15  1  0  0  0  0
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 16 17  1  0  0  0  0
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 19  7  1  0  0  0  0
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 24  8  1  0  0  0  0
 14 25  1  0  0  0  0
 12 29  1  0  0  0  0
 25 26  1  0  0  0  0
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 25 28  1  0  0  0  0
M  END
>  <Mol_ID> (228)
4265

>  <Formula> (228)
C17H20F3N7O2

>  <MolWeight> (228)
411.3816096

>  <Cat> (228)
S8738

>  <Name> (228)
Bimiralisib (PQR309)

>  <Synonyms> (228)
N/A

>  <Target> (228)
PI3K

>  <Form> (228)
Free Base

>  <CAS> (228)
1225037-39-7

>  <URL> (228)
http://www.selleckchem.com/products/pqr309-bimiralisib.html

$$$$

csChFnd80/10232010312D

 32 35  0  0  0  0  0  0  0  0999 V2000
    2.4938    3.7834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (229)
4271

>  <Formula> (229)
C21H25F3N6O2

>  <MolWeight> (229)
450.4574096

>  <Cat> (229)
S8752

>  <Name> (229)
leniolisib(CDZ 173)

>  <Synonyms> (229)
N/A

>  <Target> (229)
PI3K

>  <Form> (229)
Free Base

>  <CAS> (229)
1354690-24-6

>  <URL> (229)
http://www.selleckchem.com/products/leniolisib-cdz-173.html

$$$$

csChFnd80/10232010312D

 36 41  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (230)
4278

>  <Formula> (230)
C26H23FN8O

>  <MolWeight> (230)
482.5122232

>  <Cat> (230)
S8764

>  <Name> (230)
IITZ-01

>  <Synonyms> (230)
N/A

>  <Target> (230)
Autophagy

>  <Form> (230)
Free Base

>  <CAS> (230)
1807988-47-1

>  <URL> (230)
http://www.selleckchem.com/products/iitz-01.html

$$$$
S9031 Gambogenic acid.cdx
csChFnd80/10232010312D

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   15.0856    9.0715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (231)
4292

>  <Formula> (231)
C38H46O8

>  <MolWeight> (231)
630.76704

>  <Cat> (231)
S9031

>  <Name> (231)
Gambogenic acid

>  <Form> (231)
free base

>  <CAS> (231)
173932-75-7

$$$$
S9061 Hydroxy safflor yellow A.cdx
csChFnd80/10232010312D

 43 46  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (232)
4311

>  <Formula> (232)
C27H32O16

>  <MolWeight> (232)
612.53338

>  <Cat> (232)
S9061

>  <Name> (232)
Hydroxy safflor yellow A

>  <Form> (232)
free base

>  <CAS> (232)
78281-02-4

$$$$
S9080 Anhydroicaritin.cdx
csChFnd80/10232010312D

 27 29  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> (233)
4329

>  <Formula> (233)
C21H20O6

>  <MolWeight> (233)
368.3799

>  <Cat> (233)
S9080

>  <Name> (233)
Anhydroicaritin

>  <Form> (233)
free base

>  <CAS> (233)
118525-40-9

$$$$
S9092 Norisoboldine.cdx
csChFnd80/10232010312D

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478-61-5

$$$$
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>  <Cat> (240)
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>  <CAS> (240)
6873-13-8

$$$$
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472-11-7

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Oroxin B

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free base

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114482-86-9

$$$$

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CDK

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160807-49-8

>  <URL> (243)
http://www.selleck.cn/products/indirubin-3-monoxime.html

$$$$
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csChFnd80/10232010312D

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>  <Cat> (244)
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free base

>  <CAS> (244)
31008-19-2

$$$$
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5041-81-6

$$$$
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csChFnd80/10232010312D

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4502

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S9301

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free base

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548-37-8

$$$$
S9314 Atractylenolide II.cdx
csChFnd80/10232010312D

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>  <Cat> (247)
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free base

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73069-14-4

$$$$
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csChFnd80/10232010312D

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C21H22O7

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>  <Cat> (248)
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>  <Name> (248)
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>  <Form> (248)
free base

>  <CAS> (248)
73069-25-7

$$$$
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csChFnd80/10232010312D

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M  END
>  <Mol_ID> (249)
4669

>  <Formula> (249)
C43H44ClFN4O11S3

>  <MolWeight> (249)
943.4760632

>  <Cat> (249)
S5241

>  <Name> (249)
Lapatinib ditosylate monohydrate

>  <Synonyms> (249)
Tykerb Ditosylate

>  <Target> (249)
Others

>  <Form> (249)
ditosylate monohydrate

>  <CAS> (249)
388082-78-8

>  <URL> (249)
http://selleckchem.com/products/.html

$$$$

csChFnd80/10232010312D

 30 34  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (250)
4848

>  <Formula> (250)
C21H16FN7O

>  <MolWeight> (250)
401.3964432

>  <Cat> (250)
S5818

>  <Name> (250)
acalisib (GS-9820)

>  <Synonyms> (250)
CAL-120

>  <Target> (250)
PI3K

>  <Form> (250)
Free Base

>  <CAS> (250)
870281-34-8

>  <URL> (250)
http://www.selleckchem.com/products/acalisib-gs-9820.html

$$$$

csChFnd80/10232010312D

 33 37  0  0  0  0  0  0  0  0999 V2000
   17.4509    3.2190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.3542    2.0009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9542    1.9971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.0575    0.7903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 11 12  1  0  0  0  0
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M  END
>  <Mol_ID> (251)
4871

>  <Formula> (251)
C27H19ClN2O3

>  <MolWeight> (251)
454.90436

>  <Cat> (251)
S8803

>  <Name> (251)
MK-3903

>  <Synonyms> (251)
N/A

>  <Target> (251)
AMPK

>  <Form> (251)
Free Base

>  <CAS> (251)
1219737-12-8

>  <URL> (251)
http://www.selleckchem.com/products/mk-3903.html

$$$$

csChFnd80/10232010312D

 44 48  0  0  0  0  0  0  0  0999 V2000
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 31 36  1  0  0  0  0
 36 37  1  6  0  0  0
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M  END
>  <Mol_ID> (252)
4885

>  <Formula> (252)
C28H32O16

>  <MolWeight> (252)
624.54408

>  <Cat> (252)
S9455

>  <Name> (252)
Isorhamnetin 3-O-neohesperoside

>  <Synonyms> (252)
N/A

>  <Target> (252)
Others

>  <Form> (252)
Free Base

>  <CAS> (252)
55033-90-4

>  <URL> (252)
http://www.selleckchem.com/products/isorhamnetin-3-o-neohesperoside.html

$$$$

csChFnd80/10232010312D

 38 42  0  0  0  0  0  0  0  0999 V2000
    7.3952    4.1882    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.1465    3.4678    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.3952    5.5809    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6974    3.4678    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.9460    4.1882    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.5957    6.3009    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.6974    2.0752    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.8443    5.5809    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.1465    2.0752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5957    7.6936    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.5957    3.4678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1465    6.3009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9460    5.5809    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9460    1.3550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4489    1.3550    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.8443    4.1882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0448    6.3009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8443    8.4140    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.0448    7.8455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4489    4.1882    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3470    2.8993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1465    4.8126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6974    4.9085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7889    4.9713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2484    2.0752    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.3952    8.4140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2484    3.4678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5715    0.1519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0682    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8443    9.8066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6974    0.6826    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5957    4.9085    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9460    2.7956    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4030    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6463    8.9823    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1117    0.1519    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7196    3.5730    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0345    5.6104    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 11  1  1  0  0  0  0
  1 21  1  6  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  5  2  1  0  0  0  0
  9  2  1  0  0  0  0
  2 22  1  1  0  0  0
  6  3  1  0  0  0  0
 12  3  2  0  0  0  0
  5  4  1  0  0  0  0
 20  4  1  0  0  0  0
  4 23  1  1  0  0  0
  7  4  1  0  0  0  0
 13  5  1  0  0  0  0
  5 33  1  6  0  0  0
 10  6  1  0  0  0  0
  8  6  1  0  0  0  0
  6 32  1  1  0  0  0
 14  7  1  0  0  0  0
 15  7  1  0  0  0  0
  7 31  1  6  0  0  0
 16  8  1  0  0  0  0
 17  8  1  0  0  0  0
  8 24  1  1  0  0  0
 14  9  1  0  0  0  0
 18 10  1  0  0  0  0
 10 26  1  1  0  0  0
 10 35  1  6  0  0  0
 16 11  1  0  0  0  0
 13 12  1  0  0  0  0
 25 15  1  0  0  0  0
 15 28  1  6  0  0  0
 15 29  1  1  0  0  0
 19 17  1  0  0  0  0
 18 30  1  6  0  0  0
 19 18  1  0  0  0  0
 27 20  1  0  0  0  0
 27 25  1  0  0  0  0
 25 34  1  1  0  0  0
 36 28  1  0  0  0  0
 24 37  2  0  0  0  0
 24 38  1  0  0  0  0
M  END
>  <Mol_ID> (253)
4921

>  <Formula> (253)
C30H48O5

>  <MolWeight> (253)
488.69912

>  <Cat> (253)
S9514

>  <Name> (253)
Rotundic acid

>  <Synonyms> (253)
Rutundic acid

>  <Target> (253)
Others

>  <Form> (253)
Free Base

>  <CAS> (253)
20137-37-5

>  <URL> (253)
http://www.selleckchem.com/products/rotundic-acid.html

$$$$

csChFnd80/10232010312D

 12 12  0  0  0  0  0  0  0  0999 V2000
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8000    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
    1.2124    0.0000    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
    6.0622    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  3  6  1  0  0  0  0
  4  7  2  0  0  0  0
  5  8  1  0  0  0  0
  6  9  2  0  0  0  0
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 11  2  0  0  0  0
 10 12  1  0  0  0  0
M  END
>  <Mol_ID> (254)
4985

>  <Formula> (254)
C10H10O2

>  <MolWeight> (254)
162.1852

>  <Cat> (254)
S6221

>  <Name> (254)
Methyl cinnamate

>  <Synonyms> (254)
N/A

>  <Target> (254)
Others

>  <Form> (254)
free base

>  <CAS> (254)
103-26-4

>  <URL> (254)
http://www.selleck.cn/products/methyl-cinnamate.html

$$$$

csChFnd80/10232010312D

 31 34  0  0  0  0  0  0  0  0999 V2000
    4.8361    6.2779    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6402    6.9683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0653    8.3698    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0653    6.9876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6402    8.3871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8371    9.0789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4318    6.2706    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0453   11.1717    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8371   10.4741    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2701    2.1003    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.8556    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2745    6.2895    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2536   10.4741    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4825    2.8003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4620   12.5721    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4620   11.1718    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4825    4.1958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2745    4.8933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6743   13.2720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4318    4.8510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2359    6.9611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8870   11.1720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2701    0.7001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2199    4.1513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.2686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6744   10.4718    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8868   12.5720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6952    2.1001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6743   14.6676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4827    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6952    0.7001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  7  2  1  0  0  0  0
  3  4  2  0  0  0  0
  6  3  1  0  0  0  0
 12  4  1  0  0  0  0
  5  6  2  0  0  0  0
  9  6  1  0  0  0  0
 20  7  1  0  0  0  0
 21  7  1  0  0  0  0
  8  9  1  0  0  0  0
 13  8  2  0  0  0  0
 10 14  1  0  0  0  0
 23 10  2  0  0  0  0
 11 25  1  0  0  0  0
 11 24  1  0  0  0  0
 18 12  1  0  0  0  0
 16 13  1  0  0  0  0
 14 17  1  0  0  0  0
 28 14  2  0  0  0  0
 15 16  2  0  0  0  0
 19 15  1  0  0  0  0
 26 16  1  0  0  0  0
 17 18  1  0  0  0  0
 29 19  1  0  0  0  0
 19 27  2  0  0  0  0
 24 20  1  0  0  0  0
 25 21  1  0  0  0  0
 22 26  2  0  0  0  0
 27 22  1  0  0  0  0
 23 30  1  0  0  0  0
 31 28  1  0  0  0  0
 30 31  2  0  0  0  0
M  END
>  <Mol_ID> (255)
5320

>  <Formula> (255)
C23H26N6O2

>  <MolWeight> (255)
418.49154

>  <Cat> (255)
S6414

>  <Name> (255)
Apilimod

>  <Synonyms> (255)
STA-5326

>  <Target> (255)
PI3K

>  <Form> (255)
Free Base

>  <CAS> (255)
541550-19-0

>  <URL> (255)
http://www.selleck.cn/products/apilimod.html

$$$$

csChFnd80/10232010312D

 32 36  0  0  0  0  0  0  0  0999 V2000
    4.8205    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8205    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0330    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2454    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2454    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0329    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6081    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4578    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4578    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6703    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8827    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8827    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6703    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4578    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0951    2.1000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   12.0951    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3076    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.0951    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4617    4.1923    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0923    4.4834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3923    3.2710    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3291    2.2306    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5229    5.7624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5504    6.7694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1645    5.4237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6836    6.5452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9419    5.9315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1025    6.7144    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0049    8.1110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7465    8.7247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5859    7.9418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.1246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14  9  1  0  0  0  0
 11 15  1  0  0  0  0
 12 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  2  0  0  0  0
  7 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22  7  2  0  0  0  0
 20 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 23  1  0  0  0  0
 23 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
 21 32  1  0  0  0  0
M  END
>  <Mol_ID> (256)
5386

>  <Formula> (256)
C23H20FN7O

>  <MolWeight> (256)
429.4496032

>  <Cat> (256)
S8693

>  <Name> (256)
Selective PI3K¦Ä Inhibitor 1 (compound 7n)

>  <Synonyms> (256)
N/A

>  <Target> (256)
PI3K

>  <Form> (256)
Free Base

>  <CAS> (256)
2088525-31-7

>  <URL> (256)
http://www.selleck.cn/products/selective-pi3k-inhibitor-1.html

$$$$

csChFnd80/10232010312D

 32 35  0  0  0  0  0  0  0  0999 V2000
    6.0500    1.4025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0500    2.7977    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8417    0.7048    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2583    0.7048    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.2230    3.2351    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0461    2.1025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2230    0.9697    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8915    1.4024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8915    2.8025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6790    0.7024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4666    1.4025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4666    2.8025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6790    3.5025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8417    3.4953    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8417    4.8906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0541    5.5905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0540    6.9906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (257)
6670

>  <Formula> (257)
C22H19ClN2O6S

>  <MolWeight> (257)
474.91406

>  <Cat> (257)
S6503

>  <Name> (257)
LX2343

>  <Synonyms> (257)
N/A

>  <Target> (257)
BACE

>  <Form> (257)
free base

>  <CAS> (257)
333745-53-2

>  <URL> (257)
http://www.selleck.cn/products/lx2343.html

$$$$

csChFnd80/10232010312D

 21 24  0  0  0  0  0  0  0  0999 V2000
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 16  8  1  0  0  0  0
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M  END
>  <Mol_ID> (258)
6672

>  <Formula> (258)
C16H15N3O2

>  <MolWeight> (258)
281.3092

>  <Cat> (258)
S6506

>  <Name> (258)
Compound 401

>  <Synonyms> (258)
N/A

>  <Target> (258)
DNA-PK

>  <Form> (258)
free base

>  <CAS> (258)
168425-64-7

>  <URL> (258)
http://www.selleck.cn/products/compound-401.html

$$$$

csChFnd80/10232010312D

 34 38  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (259)
6680

>  <Formula> (259)
C21H28N8O3S2

>  <MolWeight> (259)
504.62882

>  <Cat> (259)
S6516

>  <Name> (259)
GNE-477

>  <Synonyms> (259)
N/A

>  <Target> (259)
PI3K

>  <Form> (259)
free base

>  <CAS> (259)
1032754-81-6

>  <URL> (259)
http://www.selleck.cn/products/gne-477.html

$$$$

csChFnd80/10232010312D

 22 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (260)
6694

>  <Formula> (260)
C16H14N2O2S2

>  <MolWeight> (260)
330.42456

>  <Cat> (260)
S6536

>  <Name> (260)
TTP 22

>  <Synonyms> (260)
N/A

>  <Target> (260)
Casein Kinase

>  <Form> (260)
free base

>  <CAS> (260)
329907-28-0

>  <URL> (260)
http://www.selleck.cn/products/ttp-22.html

$$$$

csChFnd80/10232010312D

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free base

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1513879-21-4

>  <URL> (263)
http://www.selleck.cn/products/bqr695.html

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1513879-19-0

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1800070-77-2

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http://www.selleck.cn/products/borussertib.html

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2230820-11-6

>  <URL> (267)
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>  <URL> (268)
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M  END
>  <Mol_ID> (269)
6929

>  <Formula> (269)
C33H40O18

>  <MolWeight> (269)
724.6599

>  <Cat> (269)
S9096

>  <Name> (269)
ligustroflavone

>  <Synonyms> (269)
Nuezhenoside

>  <Target> (269)
AMPK

>  <Form> (269)
Free Base

>  <CAS> (269)
260413-62-5

>  <URL> (269)
http://www.selleck.cn/products/ligustroflavone.html

$$$$

csChFnd80/10232010312D

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M  END
>  <Mol_ID> (270)
6941

>  <Formula> (270)
C17H15NO3

>  <MolWeight> (270)
281.3059

>  <Cat> (270)
S2272

>  <Name> (270)
Indoprofen

>  <Synonyms> (270)
N/A

>  <Target> (270)
PDK

>  <Form> (270)
Free Base

>  <CAS> (270)
31842-01-0

>  <URL> (270)
http://www.selleck.cn/products/indoprofen.html

$$$$

csChFnd80/10232010312D

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M  END
>  <Mol_ID> (271)
6984

>  <Formula> (271)
C46H51F3N6O8S2

>  <MolWeight> (271)
937.0577496

>  <Cat> (271)
S8953

>  <Name> (271)
ASP4132

>  <Synonyms> (271)
N/A

>  <Target> (271)
AMPK

>  <Form> (271)
Free Base

>  <CAS> (271)
1640294-30-9

>  <URL> (271)
http://www.selleckchem.com/products/asp4132.html

$$$$

csChFnd80/10232010312D

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Free Base

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1637771-14-2

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>  <Formula> (273)
C21H25F2N7O2

>  <MolWeight> (273)
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>  <Cat> (273)
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>  <Target> (273)
mTOR

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Free Base

>  <CAS> (273)
1927857-56-4

>  <URL> (273)
http://www.selleckchem.com/products/pqr620.html

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>  <Formula> (274)
C25H34N6O8S2

>  <MolWeight> (274)
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>  <Cat> (274)
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>  <Name> (274)
Apilimod mesylate

>  <Target> (274)
Interleukins

>  <Form> (274)
mesylate

>  <CAS> (274)
870087-36-8

>  <URL> (274)
http://www.selleckchem.com/products/apilimod-mesylate.html

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>  <Mol_ID> (275)
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>  <Formula> (275)
C7H7NO2

>  <MolWeight> (275)
137.13598

>  <Cat> (275)
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free base

>  <CAS> (275)
535-83-1

>  <URL> (275)
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csChFnd80/10232010312D

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>  <MolWeight> (276)
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>  <CAS> (276)
470-37-1

>  <URL> (276)
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    1.2098    5.9023    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.3126    2.8903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8127    0.5176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6826    3.1790    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6176    2.1370    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  5  1  1  1  0  0  0
  8  1  1  1  0  0  0
 24  2  1  1  0  0  0
  3 26  1  0  0  0  0
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  4 28  2  0  0  0  0
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  7 15  1  6  0  0  0
  8 11  1  0  0  0  0
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 10 11  1  0  0  0  0
 10 20  1  1  0  0  0
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 13 14  1  0  0  0  0
 15 18  1  0  0  0  0
 16 18  1  0  0  0  0
 16 21  1  6  0  0  0
 19 23  1  0  0  0  0
 20 25  1  0  0  0  0
 20 26  2  0  0  0  0
 21 24  1  0  0  0  0
 23 24  1  0  0  0  0
 25 27  2  0  0  0  0
 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (277)
7226

>  <Formula> (277)
C24H32O4

>  <MolWeight> (277)
384.50848

>  <Cat> (277)
S3238

>  <Name> (277)
Resibufogenin

>  <Target> (277)
RIP kinase

>  <Form> (277)
free base

>  <CAS> (277)
465-39-4

>  <URL> (277)
http://www.selleckchem.com/products/resibufogenin.html

$$$$

csChFnd80/10232010312D

 21 22  0  0  0  0  0  0  0  0999 V2000
    2.4165    4.1927    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
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  2  0  0  0  0
  1 12  1  0  0  0  0
 12 13  1  0  0  0  0
  3 14  1  0  0  0  0
 14 15  1  0  0  0  0
 10 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 10  1  0  0  0  0
 18 21  1  0  0  0  0
M  END
>  <Mol_ID> (278)
7229

>  <Formula> (278)
C17H18O4

>  <MolWeight> (278)
286.32242

>  <Cat> (278)
S3241

>  <Name> (278)
Loureirin A

>  <Target> (278)
Akt

>  <Form> (278)
free base

>  <CAS> (278)
119425-89-7

>  <URL> (278)
http://www.selleckchem.com/products/loureirin-a.html

$$$$

csChFnd80/10232010312D

 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
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   11.0792    9.2111    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  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
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  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
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 14 15  2  0  0  0  0
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 15 19  1  0  0  0  0
 16 18  1  0  0  0  0
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 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (279)
7270

>  <Formula> (279)
C19H12O7

>  <MolWeight> (279)
352.29438

>  <Cat> (279)
S3289

>  <Name> (279)
Daphnoretin

>  <Target> (279)
PKC

>  <Form> (279)
free base

>  <CAS> (279)
2034-69-7

>  <URL> (279)
http://www.selleckchem.com/products/daphnoretin.html

$$$$

csChFnd80/10232010312D

 20 22  0  0  0  0  0  0  0  0999 V2000
    1.2082    6.2927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6331    4.8927    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  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  1 11  1  0  0  0  0
  2 12  1  0  0  0  0
  7 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 14  1  0  0  0  0
 17 20  1  0  0  0  0
M  END
>  <Mol_ID> (280)
7274

>  <Formula> (280)
C16H17NO3

>  <MolWeight> (280)
271.31108

>  <Cat> (280)
S3294

>  <Name> (280)
Demethyl-Coclaurine

>  <Target> (280)
Adrenergic Receptor

>  <Form> (280)
free base

>  <CAS> (280)
5843-65-2

>  <URL> (280)
http://www.selleckchem.com/products/demethyl-coclaurine.html

$$$$

csChFnd80/10232010312D

 22 24  0  0  0  0  0  0  0  0999 V2000
    3.4951    1.2082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
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  2  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  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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 17 12  2  0  0  0  0
 16 18  1  0  0  0  0
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 19 20  1  0  0  0  0
 14 21  1  0  0  0  0
 10 22  2  0  0  0  0
M  END
>  <Mol_ID> (281)
7276

>  <Formula> (281)
C16H12O6

>  <MolWeight> (281)
300.26288

>  <Cat> (281)
S3296

>  <Name> (281)
Hispidulin

>  <Target> (281)
Pim

>  <Form> (281)
free base

>  <CAS> (281)
1447-88-7

>  <URL> (281)
http://www.selleckchem.com/products/hispidulin.html

$$$$

csChFnd80/10232010312D

 24 27  0  0  0  0  0  0  0  0999 V2000
    1.2124    3.4951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (282)
7279

>  <Formula> (282)
C19H18NO4+

>  <MolWeight> (282)
324.35052

>  <Cat> (282)
S3299

>  <Name> (282)
Demethyleneberberine

>  <Target> (282)
Peroxidases

>  <Form> (282)
free base

>  <CAS> (282)
25459-91-0

>  <URL> (282)
http://www.selleckchem.com/products/demethyleneberberine.html

$$$$

csChFnd80/10232010312D

 34 36  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (283)
7296

>  <Formula> (283)
C27H33ClN2O4

>  <MolWeight> (283)
485.01492

>  <Cat> (283)
S6760

>  <Name> (283)
LM22B-10

>  <Target> (283)
Trk receptor

>  <Form> (283)
free base

>  <CAS> (283)
342777-54-2

>  <URL> (283)
http://www.selleckchem.com/products/lm2b-10.html

$$$$

csChFnd80/10232010312D

 33 38  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (284)
7301

>  <Formula> (284)
C27H24N6

>  <MolWeight> (284)
432.51966

>  <Cat> (284)
S6811

>  <Name> (284)
Miransertib (ARQ-092)

>  <Target> (284)
Akt

>  <Form> (284)
free base

>  <CAS> (284)
1313881-70-7

>  <URL> (284)
http://www.selleckchem.com/products/miransertib.html

$$$$

csChFnd80/10232010312D

 22 23  0  0  0  0  0  0  0  0999 V2000
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 10  2  1  0  0  0  0
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 21 15  1  0  0  0  0
M  END
>  <Mol_ID> (285)
7304

>  <Formula> (285)
C15H18Cl2N2O2S

>  <MolWeight> (285)
361.28662

>  <Cat> (285)
S6847

>  <Name> (285)
ML-9 HCl

>  <Target> (285)
Akt

>  <Form> (285)
hydrochloride

>  <CAS> (285)
105637-50-1

>  <URL> (285)
http://www.selleckchem.com/products/ml-9-hcl.html

$$$$

csChFnd80/10232010312D

 30 35  0  0  0  0  0  0  0  0999 V2000
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free base

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1422365-93-2

>  <URL> (287)
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57818-44-7

>  <URL> (288)
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$$$$
