CFam Chemical Families Database
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You are searching for "CFAMM00439769" in compound.

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CFAM Mol ID CFAMM00439769
Family CFFBM16887 Gamma-aminobutyric acid receptor subunit pi and Gamma-aminobutyric acid receptor subunit gamma-3 ligand 1-[3-[[(2S)-1-methylpyrrolidin-2-yl]methyl]-1H-indol-5-yl]benzimidazole-5-carbonitrile family
Superfamily CFSBM853 Progesterone receptor and D(2) dopamine receptor Binder Superfamily 2
Class CFCAD667 Class 667
External ID CHEMBL444050 External Source CHEMBL
PubChem CID 44316547 Functional Category Bioactive
Molecule Name 1-[3-[[(2S)-1-methylpyrrolidin-2-yl]methyl]-1H-indol-5-yl]benzimidazole-5-carbonitrile
IUPAC Name 1-[3-[[(2S)-1-methylpyrrolidin-2-yl]methyl]-1H-indol-5-yl]benzimidazole-5-carbonitrile
Synonyms CHEBI:225227
InChi InChI=1S/C22H21N5/c1-26-8-2-3-17(26)10-16-13-24-20-6-5-18(11-19(16)20)27-14-25-21-9-15(12-23)4-7-22(21)27/h4-7,9,11,13-14,17,24H,2-3,8,10H2,1H3/t17-/m0/s1
InChiKey KVKYGVOAHGNAKZ-KRWDZBQOSA-N
Formula C22H21N5 Molecular Weight 355.44
Cross Link CHEMBL444050
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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