CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00230395" 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 CFAMM00230395
Family CFFID1172 Alpha-1A adrenergic receptor and Alpha-1B adrenergic receptor Ligand A-119637 Family
Superfamily CFSID948 Alpha-1A adrenergic receptor and Alpha-1B adrenergic receptor Ligand A-119637 Superfamily
Class CFCID657 Class 2007
External ID CHEMBL135878 External Source CHEMBL
PubChem CID 9842861 Functional Category Bioactive
Molecule Name SureCN6597325
IUPAC Name 1-(1-benzothiophen-3-yl)-3-[4-(2-methoxyphenyl)piperazin-1-yl]propan-1-one
Synonyms CHEBI:324014;L018472
InChi InChI=1S/C22H24N2O2S/c1-26-21-8-4-3-7-19(21)24-14-12-23(13-15-24)11-10-20(25)18-16-27-22-9-5-2-6-17(18)22/h2-9,16H,10-15H2,1H3
InChiKey VFVYVWQENQPQHA-UHFFFAOYSA-N
Formula C22H24N2O2S Molecular Weight 380.50
Cross Link CHEMBL135878
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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