CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00431508" 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 CFAMM00431508
Family CFFBM14979 Bombesin receptor subtype-3 ligand SureCN13887096 family
Superfamily CFSBM3976 Chymase and Stromelysin-3 Binder Superfamily
Class CFCCD220 Class 1033
External ID CHEMBL57104 External Source CHEMBL
PubChem CID 44300265 Functional Category Bioactive
Molecule Name AGN-PC-074AAW
IUPAC Name 2-[[[2-(4-chlorophenyl)acetyl]amino]carbamoylamino]-3-(1H-indol-3-yl)-N-(2-phenylethyl)propanamide
Synonyms CHEBI:188897;2-[[[2-(4-chlorophenyl)acetyl]amino]carbamoylamino]-3-(1H-indol-3-yl)-N-(2-phenylethyl)propanamide
InChi InChI=1S/C28H28ClN5O3/c29-22-12-10-20(11-13-22)16-26(35)33-34-28(37)32-25(17-21-18-31-24-9-5-4-8-23(21)24)27(36)30-15-14-19-6-2-1-3-7-19/h1-13,18,25,31H,14-17H2,(H,30,36)(H,33,35)(H2,32,34,37)
InChiKey ZVTSSQGUQFITGV-UHFFFAOYSA-N
Formula C28H28ClN5O3 Molecular Weight 518.01
Cross Link CHEMBL57104
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
 

 

24337 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', 'CFAMM00431508'),None, txtsearch, CFAMM00431508|