CFam Chemical Families Database
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You are searching for "CFAMM00408189" in compound.

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CFAM Mol ID CFAMM00408189
Family CFFBM11303 Coagulation factor X inhibitor AGN-PC-046QD2 family
Superfamily CFSBM4308 Coagulation factor X and Prothrombin Binder Superfamily 10
Class CFCBM176 Class 3226
External ID CHEMBL221377 External Source CHEMBL
PubChem CID 23646185 Functional Category Bioactive
Molecule Name SureCN5093526
IUPAC Name 5-methoxy-2-[6-[4-(2-methylsulfonylphenyl)phenyl]-7-oxo-3-(trifluoromethyl)-4,5-dihydropyrazolo[3,4-c]pyridin-1-yl]benzamide
Synonyms AGN-PC-046QD3;dihydropyrazolopyridinone analogue 8d;5-methoxy-2-[6-[4-(2-methylsulfonylphenyl)phenyl]-7-oxo-3-(trifluoromethyl)-4,5-dihydropyrazolo[3,4-c]pyridin-1-yl]benzamide
InChi InChI=1S/C28H23F3N4O5S/c1-40-18-11-12-22(21(15-18)26(32)36)35-24-20(25(33-35)28(29,30)31)13-14-34(27(24)37)17-9-7-16(8-10-17)19-5-3-4-6-23(19)41(2,38)39/h3-12,15H,13-14H2,1-2H3,(H2,32,36)
InChiKey JXDVPMIGKXIRMQ-UHFFFAOYSA-N
Formula C28H23F3N4O5S Molecular Weight 584.57
Cross Link CHEMBL221377
Structure

Statistics of CFAM Database

 
CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.
 

How to cite our database

 
C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).
 

Last update by

 
2014.08.29
 

 

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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