CFam Chemical Families Database
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You are searching for "CFAMM00444061" 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 CFAMM00444061
Family CFFBM17715 Dipeptidyl peptidase 4 inhibitor (2S,4S)-1-[2-[[1-[4-cyano-2-(trifluoromethyl)phenyl]piperidin-4-yl]amino]acetyl]-4-fluoropyrrolidine-2-carbonitrile family
Superfamily CFSBM956 Dipeptidyl peptidase 4 and Androgen receptor Binder Superfamily
Class CFCID263 Class 1613
External ID CHEMBL480716 External Source CHEMBL
PubChem CID 44567749 Functional Category Bioactive
Molecule Name (2S,4S)-1-[2-[[1-[4-cyano-2-(trifluoromethyl)phenyl]piperidin-4-yl]amino]acetyl]-4-fluoropyrrolidine-2-carbonitrile
IUPAC Name (2S,4S)-1-[2-[[1-[4-cyano-2-(trifluoromethyl)phenyl]piperidin-4-yl]amino]acetyl]-4-fluoropyrrolidine-2-carbonitrile
Synonyms CHEBI:566952
InChi InChI=1S/C20H21F4N5O/c21-14-8-16(10-26)29(12-14)19(30)11-27-15-3-5-28(6-4-15)18-2-1-13(9-25)7-17(18)20(22,23)24/h1-2,7,14-16,27H,3-6,8,11-12H2/t14-,16-/m0/s1
InChiKey LOSVSQIORWPERB-HOCLYGCPSA-N
Formula C20H21F4N5O Molecular Weight 423.41
Cross Link CHEMBL480716
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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