CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00142677" 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 CFAMM00142677
Family CFFCD201 C-C chemokine receptor type 5 Ligand GW873140 Family
Superfamily CFSAD343 Glucan synthesis regulatory protein Inhibitor Anidulafungin Superfamily
Class CFCAD322 Class 322
External ID CHEMBL372410 External Source CHEMBL
PubChem CID 11562461 Functional Category Bioactive
Molecule Name AGN-PC-00BN4A
IUPAC Name N-[1-(cyanomethylcarbamoyl)cyclohexyl]-4-[4-[1-(2-hydroxyethyl)piperidin-4-yl]oxyphenyl]benzamide
Synonyms N-[1-(cyanomethylcarbamoyl)cyclohexyl]-4-[4-[1-(2-hydroxyethyl)piperidin-4-yl]oxyphenyl]benzamide
InChi InChI=1S/C29H36N4O4/c30-16-17-31-28(36)29(14-2-1-3-15-29)32-27(35)24-6-4-22(5-7-24)23-8-10-25(11-9-23)37-26-12-18-33(19-13-26)20-21-34/h4-11,26,34H,1-3,12-15,17-21H2,(H,31,36)(H,32,35)
InChiKey ARUOKGIJLBMXHU-UHFFFAOYSA-N
Formula C29H36N4O4 Molecular Weight 504.62
Cross Link CHEMBL372410
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
 

 

84139 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', 'CFAMM00142677'),None, txtsearch, CFAMM00142677|