CFam Chemical Families Database
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You are searching for "CFAMM00045809" in compound.

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CFAM Mol ID CFAMM00045809
Family CFFAD271 Histamine H1 receptor Ligand Azelastine Family
Superfamily CFSAD240 Histamine H1 receptor Ligand Azelastine Superfamily
Class CFCAD230 Class 230
External ID DNC013017 External Source TTD
PubChem CID 11522042 Functional Category Investigative Drug
Molecule Name 4-(4-chlorobenzyl)-2-methylphthalazin-1(2H)-one
IUPAC Name 4-[(4-chlorophenyl)methyl]-2-methylphthalazin-1-one
Synonyms AGN-PC-00AT6P;CHEMBL67457;CHEBI:205404;DNC013017;4-(4-chlorobenzyl)-2-methylphthalazin-1(2H)-one
InChi InChI=1S/C16H13ClN2O/c1-19-16(20)14-5-3-2-4-13(14)15(18-19)10-11-6-8-12(17)9-7-11/h2-9H,10H2,1H3
InChiKey QZOXWSKLFOUEKD-UHFFFAOYSA-N
Formula C16H13ClN2O Molecular Weight 284.74
Cross Link CHEMBL67457
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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