CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00329489" in compound.

Total 1 results found.

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 CFAMM00329489
Family CFFBM2009 D(4) dopamine receptor and D(2) dopamine receptor ligand 7-[[4-(3-chloro-4-methylphenyl)piperazin-1-yl]methyl]chromen-2-one family
Superfamily CFSCD425 D(4) dopamine receptor Ligand PD-165167 Superfamily
Class CFCAD615 Class 615
External ID ZINC54106035 External Source ZINC
PubChem CID 665507 Functional Category Natural Product
Molecule Name SMR000046691
IUPAC Name 6-chloro-4-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-5,7-dimethylchromen-2-one
Synonyms AC1LDDYI;MLS000083475;MLS001305218;STOCK5S-10845;MolPort-002-631-744;HMS2292B12;STK718798;ZINC54106035;AKOS002228782;MCULE-8063639053
InChi InChI=1S/C23H25ClN2O3/c1-15-12-20-22(16(2)23(15)24)17(13-21(27)29-20)14-25-8-10-26(11-9-25)18-4-6-19(28-3)7-5-18/h4-7,12-13H,8-11,14H2,1-3H3
InChiKey FDDLOECIFZWJCW-UHFFFAOYSA-N
Formula C23H25ClN2O3 Molecular Weight 412.91
Cross Link
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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