CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00333389" 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 CFAMM00333389
Family CFFBM2375 D(3) dopamine receptor and D(1A) dopamine receptor ligand N-[(E)-4-[4-(2-methoxyphenyl)piperazin-1-yl]but-2-enyl]-1-benzothiophene-2-carboxamide family
Superfamily CFSBM1317 D(3) dopamine receptor and D(2) dopamine receptor Binder Superfamily 6
Class CFCID208 Class 1558
External ID CHEMBL75582 External Source CHEMBL
PubChem CID 10001614 Functional Category Bioactive
Molecule Name SureCN9467179
IUPAC Name N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-1,2-benzothiazole-3-carboxamide
Synonyms CHEBI:220024
InChi InChI=1S/C22H26N4O2S/c1-28-19-9-4-3-8-18(19)26-15-13-25(14-16-26)12-6-11-23-22(27)21-17-7-2-5-10-20(17)29-24-21/h2-5,7-10H,6,11-16H2,1H3,(H,23,27)
InChiKey MQPHIJKZERHYFD-UHFFFAOYSA-N
Formula C22H26N4O2S Molecular Weight 410.53
Cross Link CHEMBL75582
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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