CFam Chemical Families Database
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You are searching for "CFAMM00409230" in compound.

Total 1 results found.

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 CFAMM00409230
Family CFFBM11409 Cathepsin S and Cathepsin K inhibitor SureCN3018173 family
Superfamily CFSCD686 Emricasan Superfamily
Class CFCCD484 Class 1297
External ID CHEMBL574936 External Source CHEMBL
PubChem CID 45482515 Functional Category Bioactive
Molecule Name (1S,4S,5R)-3-butylsulfonyl-N-[4-(trifluoromethoxy)phenyl]-3-azabicyclo[2.2.2]octane-5-carboxamide
IUPAC Name (1S,4S,5R)-3-butylsulfonyl-N-[4-(trifluoromethoxy)phenyl]-3-azabicyclo[2.2.2]octane-5-carboxamide
Synonyms CHEBI:670345
InChi InChI=1S/C19H25F3N2O4S/c1-2-3-10-29(26,27)24-12-13-4-9-17(24)16(11-13)18(25)23-14-5-7-15(8-6-14)28-19(20,21)22/h5-8,13,16-17H,2-4,9-12H2,1H3,(H,23,25)/t13-,16+,17-/m0/s1
InChiKey MFTIMBVMXDIZOP-XKQJLSEDSA-N
Formula C19H25F3N2O4S Molecular Weight 434.47
Cross Link CHEMBL574936
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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