CFam Chemical Families Database
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You are searching for "CFAMM00005997" 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 CFAMM00005997
Family CFFAD21 Benzodiazepine receptor ligand benzodiazepine derivative Fludiazepam Family
Superfamily CFSAD21 Benzodiazepine receptor, GABA receptor binding benzodiazepine derivatives Superfamily
Class CFCAD21 Class 21
External ID CHEMBL356411 External Source CHEMBL
PubChem CID 44366138 Functional Category Bioactive
Molecule Name AGN-PC-075ROL
IUPAC Name 8-chloro-5-(2-fluorophenyl)-7-methyl-1,3-dihydro-1,4-benzodiazepin-2-one
Synonyms CHEBI:349176;Ro-208552;8-chloro-5-(2-fluorophenyl)-7-methyl-1,3-dihydro-1,4-benzodiazepin-2-one
InChi InChI=1S/C16H12ClFN2O/c1-9-6-11-14(7-12(9)17)20-15(21)8-19-16(11)10-4-2-3-5-13(10)18/h2-7H,8H2,1H3,(H,20,21)
InChiKey GANKBGRUGXCJBG-UHFFFAOYSA-N
Formula C16H12ClFN2O Molecular Weight 302.73
Cross Link CHEMBL356411
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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