CFam Chemical Families Database
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You are searching for "CFAMM00011347" in compound.

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CFAM Mol ID CFAMM00011347
Family CFFAD60 5-hydroxytryptamine receptor 1B and 5-hydroxytryptamine receptor 1D ligand triptan analog Frovatriptan family
Superfamily CFSAD59 5-hydroxytryptamine receptor 1B and 5-hydroxytryptamine receptor 1D ligand triptan analog Frovatriptan Superfamily
Class CFCAD59 Class 59
External ID CHEMBL295595 External Source CHEMBL
PubChem CID 44293151 Functional Category Bioactive
Molecule Name AGN-PC-073QB7
IUPAC Name 2-(3,5-dimethylphenyl)-N-ethyl-N-propan-2-yl-3-[2-(4-pyridin-3-ylbutylamino)ethyl]-1H-indole-5-carboxamide
Synonyms CHEBI:172425;2-(3,5-dimethylphenyl)-N-ethyl-N-propan-2-yl-3-[2-(4-pyridin-3-ylbutylamino)ethyl]-1H-indole-5-carboxamide
InChi InChI=1S/C33H42N4O/c1-6-37(23(2)3)33(38)27-12-13-31-30(21-27)29(32(36-31)28-19-24(4)18-25(5)20-28)14-17-34-15-8-7-10-26-11-9-16-35-22-26/h9,11-13,16,18-23,34,36H,6-8,10,14-15,17H2,1-5H3
InChiKey FYXJSQODWMKBFP-UHFFFAOYSA-N
Formula C33H42N4O Molecular Weight 510.71
Cross Link CHEMBL295595
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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