CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00470638" 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 CFAMM00470638
Family CFFBM24598 Leukotriene B4 receptor 1 ligand 4-methoxy-3-[[(E)-3-(4-phenylphenyl)but-2-enoyl]amino]benzoic acid family
Superfamily CFSID334 Glycogen phosphorylase, muscle form and Receptor tyrosine-protein kinase erbB-2 Binder Superfamily
Class CFCID233 Class 1583
External ID CHEMBL120243 External Source CHEMBL
PubChem CID 10136188 Functional Category Bioactive
Molecule Name AGN-PC-00JQE3
IUPAC Name 2-[[4-methoxy-3-[[2-[4-(trifluoromethyl)phenyl]acetyl]amino]phenyl]methyl]butanoic acid
Synonyms SureCN3942737;CHEBI:297500;(2S)-2-[[4-methoxy-3-[[2-[4-(trifluoromethyl)phenyl]acetyl]amino]phenyl]methyl]butanoic acid
InChi InChI=1S/C21H22F3NO4/c1-3-15(20(27)28)10-14-6-9-18(29-2)17(11-14)25-19(26)12-13-4-7-16(8-5-13)21(22,23)24/h4-9,11,15H,3,10,12H2,1-2H3,(H,25,26)(H,27,28)
InChiKey RENIXNFHBZKVGV-UHFFFAOYSA-N
Formula C21H22F3NO4 Molecular Weight 409.40
Cross Link CHEMBL120243
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
 

 

71227 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', 'CFAMM00470638'),None, txtsearch, CFAMM00470638|