CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00001674" 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 CFAMM00001674
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 CHEMBL11009 External Source CHEMBL
PubChem CID 10046374 Functional Category Bioactive
Molecule Name N-[2-[2-(3,5-dimethylphenyl)-1H-indol-3-yl]ethyl]-4-pyridin-4-ylbutan-1-amine
IUPAC Name N-[2-[2-(3,5-dimethylphenyl)-1H-indol-3-yl]ethyl]-4-pyridin-4-ylbutan-1-amine
Synonyms CHEBI:108669
InChi InChI=1S/C27H31N3/c1-20-17-21(2)19-23(18-20)27-25(24-8-3-4-9-26(24)30-27)12-16-28-13-6-5-7-22-10-14-29-15-11-22/h3-4,8-11,14-15,17-19,28,30H,5-7,12-13,16H2,1-2H3
InChiKey DTLBVHBEDJEATA-UHFFFAOYSA-N
Formula C27H31N3 Molecular Weight 397.56
Cross Link CHEMBL11009
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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