CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00244552" 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 CFAMM00244552
Family CFFID1599 Kappa-type opioid receptor Ligand ICI-204448 Family
Superfamily CFSID1249 Kappa-type opioid receptor Ligand ICI-204448 Superfamily
Class CFCID825 Class 2175
External ID CHEMBL185554 External Source CHEMBL
PubChem CID 9981894 Functional Category Bioactive
Molecule Name 2-[3-[1-[methyl-[2-[4-(trifluoromethyl)phenyl]acetyl]amino]-2-pyrrolidin-1-ylethyl]phenoxy]acetic acid
IUPAC Name 2-[3-[1-[methyl-[2-[4-(trifluoromethyl)phenyl]acetyl]amino]-2-pyrrolidin-1-ylethyl]phenoxy]acetic acid
Synonyms CHEBI:405893
InChi InChI=1S/C24H27F3N2O4/c1-28(22(30)13-17-7-9-19(10-8-17)24(25,26)27)21(15-29-11-2-3-12-29)18-5-4-6-20(14-18)33-16-23(31)32/h4-10,14,21H,2-3,11-13,15-16H2,1H3,(H,31,32)
InChiKey YRWWZNCXCQAWEQ-UHFFFAOYSA-N
Formula C24H27F3N2O4 Molecular Weight 464.48
Cross Link CHEMBL185554
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
 

 

27433 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', 'CFAMM00244552'),None, txtsearch, CFAMM00244552|