CFam Chemical Families Database
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You are searching for "CFAMM00322594" in compound.

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CFAM Mol ID CFAMM00322594
Family CFFBM1369 Dipeptidyl peptidase 4 inhibitor Xanthine Analogue 4 family
Superfamily CFSBM779 Dipeptidyl peptidase 4 Binder Superfamily 4
Class CFCCD214 Class 1027
External ID CHEMBL1161914 External Source CHEMBL
PubChem CID 23646518 Functional Category Bioactive
Molecule Name AGN-PC-046QKN
IUPAC Name 2-(3-aminopiperidin-1-yl)-1-[(2-cyanophenyl)methyl]-4-N,5-N-dimethylimidazole-4,5-dicarboxamide
Synonyms Xanthine mimetic compound 19;2-(3-aminopiperidin-1-yl)-1-[(2-cyanophenyl)methyl]-4-N,5-N-dimethylimidazole-4,5-dicarboxamide
InChi InChI=1S/C20H25N7O2/c1-23-18(28)16-17(19(29)24-2)27(11-14-7-4-3-6-13(14)10-21)20(25-16)26-9-5-8-15(22)12-26/h3-4,6-7,15H,5,8-9,11-12,22H2,1-2H3,(H,23,28)(H,24,29)
InChiKey LHRRHKGNJMJPKU-UHFFFAOYSA-N
Formula C20H25N7O2 Molecular Weight 395.46
Cross Link CHEMBL1161914
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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