CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00334986" 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 CFAMM00334986
Family CFFBM2510 Casein kinase I isoform delta and Mitogen-activated protein kinase 14 inhibitor (E)-3-(2,4-dimethoxyphenyl)-N-[4-[5-(4-fluorophenyl)-2-methylsulfanyl-1H-imidazol-4-yl]pyridin-2-yl]prop-2-enamide family
Superfamily CFSAD147 Potassium-transporting ATPase alpha chain 1 Inhibitor Rabeprazole Superfamily
Class CFCAD145 Class 145
External ID CHEMBL1272054 External Source CHEMBL
PubChem CID 52941893 Functional Category Bioactive
Molecule Name (E)-3-(2,4-dimethoxyphenyl)-N-[4-[3-ethyl-5-(4-fluorophenyl)-2-methylsulfanylimidazol-4-yl]pyridin-2-yl]prop-2-enamide
IUPAC Name (E)-3-(2,4-dimethoxyphenyl)-N-[4-[3-ethyl-5-(4-fluorophenyl)-2-methylsulfanylimidazol-4-yl]pyridin-2-yl]prop-2-enamide
Synonyms CHEBI:811313
InChi InChI=1S/C28H27FN4O3S/c1-5-33-27(26(32-28(33)37-4)19-6-10-21(29)11-7-19)20-14-15-30-24(16-20)31-25(34)13-9-18-8-12-22(35-2)17-23(18)36-3/h6-17H,5H2,1-4H3,(H,30,31,34)/b13-9+
InChiKey NDDLUMQCNXACPK-UKTHLTGXSA-N
Formula C28H27FN4O3S Molecular Weight 518.60
Cross Link CHEMBL1272054
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
 

 

26815 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', 'CFAMM00334986'),None, txtsearch, CFAMM00334986|