CFam Chemical Families Database
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You are searching for "CFAMM00001634" in compound.

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CFAM Mol ID CFAMM00001634
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 CHEMBL93868 External Source CHEMBL
PubChem CID 9927441 Functional Category Bioactive
Molecule Name SureCN3322247
IUPAC Name 2-[1-(benzenesulfonyl)indol-3-yl]-N,N-dimethylethanamine
Synonyms CHEBI:254831;PDSP1_000375;PDSP2_000373
InChi InChI=1S/C18H20N2O2S/c1-19(2)13-12-15-14-20(18-11-7-6-10-17(15)18)23(21,22)16-8-4-3-5-9-16/h3-11,14H,12-13H2,1-2H3
InChiKey NKLZWGMWROXIDH-UHFFFAOYSA-N
Formula C18H20N2O2S Molecular Weight 328.43
Cross Link CHEMBL93868
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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