CFam Chemical Families Database
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You are searching for "CFAMM00099205" 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 CFAMM00099205
Family CFFAD731 Histamine H1 receptor Ligand Triprolidine Family
Superfamily CFSAD143 Histamine H1 receptor ligand Pheniramine Triprolidine, Nicotinic acetylcholine receptor ligand Nicotine Superfamily
Class CFCAD141 Class 141
External ID CHEMBL81276 External Source CHEMBL
PubChem CID 10090247 Functional Category Bioactive
Molecule Name 2-[2-[6-(trifluoromethyl)indol-1-yl]ethyl]-3,4,5,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a][1,4]diazepine
IUPAC Name 2-[2-[6-(trifluoromethyl)indol-1-yl]ethyl]-3,4,5,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a][1,4]diazepine
Synonyms CHEBI:229300
InChi InChI=1S/C20H26F3N3/c21-20(22,23)17-6-5-16-7-11-26(19(16)14-17)13-12-24-8-3-10-25-9-2-1-4-18(25)15-24/h5-7,11,14,18H,1-4,8-10,12-13,15H2
InChiKey NQTQBHKGMLJHTR-UHFFFAOYSA-N
Formula C20H26F3N3 Molecular Weight 365.44
Cross Link CHEMBL81276
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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