CFam Chemical Families Database
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You are searching for "CFAMM00330222" 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 CFAMM00330222
Family CFFBM2079 Gamma-aminobutyric acid receptor subunit pi and GABA theta subunit ligand SureCN9077233 family
Superfamily CFSBM1174 Cruzipain and Cationic trypsin Binder Superfamily
Class CFCAD667 Class 667
External ID 18414225 External Source PubChem
PubChem CID 18414225 Functional Category Patent Compound
Molecule Name AGN-PC-01VP8Z
IUPAC Name 1-[2-[2-oxo-4-(1-phenylbenzimidazol-5-yl)pyridin-1-yl]ethyl]piperidine-4-carbonitrile
Synonyms SureCN7677147;1-[2-[2-oxo-4-(1-phenylbenzimidazol-5-yl)pyridin-1-yl]ethyl]piperidine-4-carbonitrile
InChi InChI=1S/C26H25N5O/c27-18-20-8-11-29(12-9-20)14-15-30-13-10-22(17-26(30)32)21-6-7-25-24(16-21)28-19-31(25)23-4-2-1-3-5-23/h1-7,10,13,16-17,19-20H,8-9,11-12,14-15H2
InChiKey YXLPWSIVQNFYDW-UHFFFAOYSA-N
Formula C26H25N5O Molecular Weight 423.51
Cross Link
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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