CFam Chemical Families Database
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You are searching for "CFAMM00001548" 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 CFAMM00001548
Family CFFAD8 5-hydroxytryptamine receptor 1B ligand triptan Almotriptan Family
Superfamily CFSAD8 5-hydroxytryptamine receptor 1B ligand triptan Almotriptan Superfamily
Class CFCAD8 Class 8
External ID CHEMBL171129 External Source CHEMBL
PubChem CID 44214329 Functional Category Bioactive
Molecule Name AGN-PC-072QDG
IUPAC Name N,N-dimethyl-2-(5-thiophen-3-yl-1H-indol-3-yl)ethanamine
Synonyms SureCN8686111;CHEBI:386009;L017367;1H-Indole-3-ethanamine, N,N-dimethyl-5-(3-thienyl)-
InChi InChI=1S/C16H18N2S/c1-18(2)7-5-13-10-17-16-4-3-12(9-15(13)16)14-6-8-19-11-14/h3-4,6,8-11,17H,5,7H2,1-2H3
InChiKey LFSZRZQJRBZNHZ-UHFFFAOYSA-N
Formula C16H18N2S Molecular Weight 270.39
Cross Link CHEMBL171129
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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