CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00316817" 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 CFAMM00316817
Family CFFBM885 Renin inhibitor AGN-PC-07ZC01 family
Superfamily CFSBM501 Renin and Potassium voltage-gated channel subfamily H member 2 Binder Superfamily
Class CFCBM74 Class 3124
External ID CHEMBL1092186 External Source CHEMBL
PubChem CID 15981115 Functional Category Bioactive
Molecule Name AGN-PC-00QPXT
IUPAC Name 2-(aminomethyl)-N-cyclopropyl-3-[4-[3-(2,6-dichloro-4-methylphenoxy)propyl]phenyl]-N-[(2,3-dichlorophenyl)methyl]propanamide
Synonyms SureCN661727;CHEBI:719488;2-(aminomethyl)-N-cyclopropyl-3-[4-[3-(2,6-dichloro-4-methylphenoxy)propyl]phenyl]-N-[(2,3-dichlorophenyl)methyl]propanamide
InChi InChI=1S/C30H32Cl4N2O2/c1-19-14-26(32)29(27(33)15-19)38-13-3-4-20-7-9-21(10-8-20)16-23(17-35)30(37)36(24-11-12-24)18-22-5-2-6-25(31)28(22)34/h2,5-10,14-15,23-24H,3-4,11-13,16-18,35H2,1H3
InChiKey HHFNUPNPOFOJPD-UHFFFAOYSA-N
Formula C30H32Cl4N2O2 Molecular Weight 594.40
Cross Link CHEMBL1092186
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
 

 

27397 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', 'CFAMM00316817'),None, txtsearch, CFAMM00316817|