CFam Chemical Families Database
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You are searching for "CFAMM00326426" in compound.

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Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00326426
Family CFFBM1687 Cathepsin S and Cathepsin K inhibitor SureCN1629664 family
Superfamily CFSBM975 cGMP-specific 3',5'-cyclic phosphodiesterase and Cathepsin S Binder Superfamily
Class CFCCD163 Class 976
External ID CHEMBL1669282 External Source CHEMBL
PubChem CID 53322117 Functional Category Bioactive
Molecule Name AGN-PC-09QK8B
IUPAC Name 1-methyl-6-[4-[2-(1-methylsulfonylpiperidin-4-yl)ethoxy]-3-(trifluoromethyl)phenyl]imidazo[4,5-c]pyridine-4-carbonitrile
Synonyms SureCN2386567;CHEBI:1168195;1-methyl-6-[4-[2-(1-methylsulfonylpiperidin-4-yl)ethoxy]-3-(trifluoromethyl)phenyl]imidazo[4,5-c]pyridine-4-carbonitrile
InChi InChI=1S/C23H24F3N5O3S/c1-30-14-28-22-19(13-27)29-18(12-20(22)30)16-3-4-21(17(11-16)23(24,25)26)34-10-7-15-5-8-31(9-6-15)35(2,32)33/h3-4,11-12,14-15H,5-10H2,1-2H3
InChiKey LQFGGDAIICQKPL-UHFFFAOYSA-N
Formula C23H24F3N5O3S Molecular Weight 507.53
Cross Link CHEMBL1669282
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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