CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00113103" 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 CFAMM00113103
Family CFFAD921 Muscarinic acetylcholine receptor Ligand Mebeverine Family
Superfamily CFSAD775 Muscarinic acetylcholine receptor Ligand Mebeverine Superfamily
Class CFCAD333 Class 333
External ID 22462669 External Source PubChem
PubChem CID 22462669 Functional Category Patent Compound
Molecule Name AGN-PC-03P9MW
IUPAC Name methyl 3-methoxy-4-(2-pyrrolidin-1-ylethoxy)benzoate
Synonyms SureCN6174157;Benzoic acid, 3-methoxy-4-[2-(1-pyrrolidinyl)ethoxy]-, methyl ester
InChi InChI=1S/C15H21NO4/c1-18-14-11-12(15(17)19-2)5-6-13(14)20-10-9-16-7-3-4-8-16/h5-6,11H,3-4,7-10H2,1-2H3
InChiKey JLCABAQNJUMHJR-UHFFFAOYSA-N
Formula C15H21NO4 Molecular Weight 279.33
Cross Link
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
 

 

27648 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', 'CFAMM00113103'),None, txtsearch, CFAMM00113103|