CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00396233" 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 CFAMM00396233
Family CFFBM9535 Nitric oxide synthase, inducible and Nitric oxide synthase, brain inhibitor 4-[(3-chloro-N-pyrazin-2-ylanilino)methyl]-7,8-difluoro-1H-quinolin-2-one family
Superfamily CFSBM4878 GABA theta subunit and Nitric oxide synthase, brain Binder Superfamily
Class CFCCD117 Class 930
External ID CHEMBL1944723 External Source CHEMBL
PubChem CID 25211401 Functional Category Bioactive
Molecule Name 4-[[(4-chlorophenyl)methyl-pyrazin-2-ylamino]methyl]-7,8-difluoro-1H-quinolin-2-one
IUPAC Name 4-[[(4-chlorophenyl)methyl-pyrazin-2-ylamino]methyl]-7,8-difluoro-1H-quinolin-2-one
Synonyms SureCN4052152
InChi InChI=1S/C21H15ClF2N4O/c22-15-3-1-13(2-4-15)11-28(18-10-25-7-8-26-18)12-14-9-19(29)27-21-16(14)5-6-17(23)20(21)24/h1-10H,11-12H2,(H,27,29)
InChiKey QAQBQANOVVCKFW-UHFFFAOYSA-N
Formula C21H15ClF2N4O Molecular Weight 412.82
Cross Link CHEMBL1944723
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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