CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00035910" in compound.

Total 1 results found.

Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

Search Results

CFAM Mol ID CFAMM00035910
Family CFFAD197 Alpha-2 adrenergic receptor Ligand Dexmedetomidine Family
Superfamily CFSAD183 Alpha-2 adrenergic receptor Ligand Dexmedetomidine Superfamily
Class CFCAD177 Class 177
External ID CHEMBL246833 External Source CHEMBL
PubChem CID 11620552 Functional Category Bioactive
Molecule Name AGN-PC-00CTIU
IUPAC Name 1-[4-phenyl-5-[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-4-[3-(trifluoromethyl)pyridin-2-yl]piperazine
Synonyms CHEBI:515312;1-[4-phenyl-5-[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-4-[3-(trifluoromethyl)pyridin-2-yl]piperazine
InChi InChI=1S/C26H21F6N5/c27-25(28,29)19-10-8-18(9-11-19)22-21(17-5-2-1-3-6-17)34-24(35-22)37-15-13-36(14-16-37)23-20(26(30,31)32)7-4-12-33-23/h1-12H,13-16H2,(H,34,35)
InChiKey VCVGVKFIQIWAMK-UHFFFAOYSA-N
Formula C26H21F6N5 Molecular Weight 517.47
Cross Link CHEMBL246833
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
 

 

23968 visits since 2014 .........

 



Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


All rights reserved.

   
 
 
Computer-aided Drug Design
about BIDD |  databases |  software |  teaching |  research |  links

 

Department of Computational Science | National University of Singapore | Blk S17, 3 Science Drive 2, Singapore 117543

hdnkeywordtype:MiniFieldStorage('hdnkeywordtype', 'compound'),None, hdnkeywordtype, compound|txtsearch:MiniFieldStorage('txtsearch', 'CFAMM00035910'),None, txtsearch, CFAMM00035910|