CFam Chemical Families Database
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You are searching for "CFAMM00396167" in compound.

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CFAM Mol ID CFAMM00396167
Family CFFBM9525 Prothrombin inhibitor SureCN6925359 family
Superfamily CFSBM2286 Cruzipain and Prothrombin Binder Superfamily 2
Class CFCCD161 Class 974
External ID CHEMBL194569 External Source CHEMBL
PubChem CID 44404188 Functional Category Bioactive
Molecule Name AGN-PC-075XEL
IUPAC Name N-[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]-2-[[2-(1,3-dihydro-1,2,4-triazol-2-yl)phenyl]methyl]-[1,3]oxazolo[4,5-c]pyridin-4-amine
Synonyms CHEBI:429939;N-[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]-2-[[2-(1,3-dihydro-1,2,4-triazol-2-yl)phenyl]methyl]-[1,3]oxazolo[4,5-c]pyridin-4-amine
InChi InChI=1S/C22H19F2N7O2/c23-22(24,18-7-3-4-10-31(18)32)12-27-21-20-17(8-9-26-21)33-19(29-20)11-15-5-1-2-6-16(15)30-14-25-13-28-30/h1-10,13H,11-12,14H2,(H,25,28)(H,26,27)
InChiKey QGNIEHVRQPFGKU-UHFFFAOYSA-N
Formula C22H19F2N7O2 Molecular Weight 451.43
Cross Link CHEMBL194569
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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