CFam Chemical Families Database
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You are searching for "CFAMM00157649" 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 CFAMM00157649
Family CFFCD445 D(1B) dopamine receptor Ligand LE-300 Family
Superfamily CFSCD406 D(1B) dopamine receptor Ligand LE-300 Superfamily
Class CFCCD292 Class 1105
External ID CHEMBL90911 External Source CHEMBL
PubChem CID 44324052 Functional Category Bioactive
Molecule Name AGN-PC-074OKX
IUPAC Name N-ethyl-N-methyl-2-[2-[3-(trifluoromethyl)phenyl]-1H-indol-3-yl]ethanamine
Synonyms CHEBI:246914;N-ethyl-N-methyl-2-[2-[3-(trifluoromethyl)phenyl]-1H-indol-3-yl]ethanamine
InChi InChI=1S/C20H21F3N2/c1-3-25(2)12-11-17-16-9-4-5-10-18(16)24-19(17)14-7-6-8-15(13-14)20(21,22)23/h4-10,13,24H,3,11-12H2,1-2H3
InChiKey QBUNYKZCKJJRII-UHFFFAOYSA-N
Formula C20H21F3N2 Molecular Weight 346.39
Cross Link CHEMBL90911
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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