CFam Chemical Families Database
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You are searching for "CFAMM00432296" in compound.

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CFAM Mol ID CFAMM00432296
Family CFFBM15094 Gamma-aminobutyric acid receptor subunit gamma-2 and Gamma-aminobutyric acid receptor subunit beta-3 ligand AGN-PC-073OYD family
Superfamily CFSBM6313 Gamma-aminobutyric acid receptor subunit gamma-2 and Gamma-aminobutyric acid receptor subunit beta-3 Binder Superfamily
Class CFCBM320 Class 3370
External ID CHEMBL44985 External Source CHEMBL
PubChem CID 44291297 Functional Category Bioactive
Molecule Name AGN-PC-073P7M
IUPAC Name 12-(1-methylimidazol-2-yl)-10-(4-methyl-1,3-thiazol-2-yl)-6,7-dihydro-5H-dipyrido[2,3-b:1',3'-d]azepin-9-one
Synonyms CHEBI:168545;12-(1-methylimidazol-2-yl)-10-(4-methyl-1,3-thiazol-2-yl)-6,7-dihydro-5H-dipyrido[2,3-b:1',3'-d]azepin-9-one
InChi InChI=1S/C21H19N5OS/c1-13-12-28-20(24-13)16-10-15(19-23-7-9-25(19)2)18-17-11-22-6-5-14(17)4-3-8-26(18)21(16)27/h5-7,9-12H,3-4,8H2,1-2H3
InChiKey XRIXNULAASCVLG-UHFFFAOYSA-N
Formula C21H19N5OS Molecular Weight 389.47
Cross Link CHEMBL44985
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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