CFam Chemical Families Database
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You are searching for "CFAMM00395399" in compound.

Total 1 results found.

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CFAM Mol ID CFAMM00395399
Family CFFBM9428 Bifunctional epoxide hydrolase 2 inhibitor AGN-PC-0733AC family
Superfamily CFSBM4848 Dipeptidyl peptidase 4 and Bifunctional epoxide hydrolase 2 Binder Superfamily
Class CFCCD421 Class 1234
External ID CHEMBL468175 External Source CHEMBL
PubChem CID 44577551 Functional Category Bioactive
Molecule Name AGN-PC-077KFM
IUPAC Name 3-(2-chloro-4-fluorophenyl)-5-[1-[8-(trifluoromethyl)quinolin-3-yl]piperidin-4-yl]-1,2,4-oxadiazole
Synonyms CHEBI:588281;3-(2-chloro-4-fluorophenyl)-5-[1-[8-(trifluoromethyl)quinolin-3-yl]piperidin-4-yl]-1,2,4-oxadiazole
InChi InChI=1S/C23H17ClF4N4O/c24-19-11-15(25)4-5-17(19)21-30-22(33-31-21)13-6-8-32(9-7-13)16-10-14-2-1-3-18(23(26,27)28)20(14)29-12-16/h1-5,10-13H,6-9H2
InChiKey QCKIBTZYAAOBTL-UHFFFAOYSA-N
Formula C23H17ClF4N4O Molecular Weight 476.85
Cross Link CHEMBL468175
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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