CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00380708" 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 CFAMM00380708
Family CFFBM7490 C-C chemokine receptor type 5 ligand SureCN3684128 family
Superfamily CFSCD163 C-C chemokine receptor type 5 Ligand Vicriviroc Superfamily
Class CFCCD11 Class 824
External ID CHEMBL1085221 External Source CHEMBL
PubChem CID 25206397 Functional Category Bioactive
Molecule Name SureCN3940658
IUPAC Name 4-[[(4R)-3-[1-[1-(4,6-dimethylpyrimidine-5-carbonyl)-4-methylpiperidin-4-yl]piperidin-4-yl]-2-oxo-4-phenylimidazolidin-1-yl]methyl]-N-methylpiperidine-1-carboxamide
Synonyms CHEBI:732076
InChi InChI=1S/C35H50N8O3/c1-25-31(26(2)38-24-37-25)32(44)39-20-14-35(3,15-21-39)42-18-12-29(13-19-42)43-30(28-8-6-5-7-9-28)23-41(34(43)46)22-27-10-16-40(17-11-27)33(45)36-4/h5-9,24,27,29-30H,10-23H2,1-4H3,(H,36,45)/t30-/m0/s1
InChiKey PEYUSKSYYONOAP-PMERELPUSA-N
Formula C35H50N8O3 Molecular Weight 630.82
Cross Link CHEMBL1085221
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', 'CFAMM00380708'),None, txtsearch, CFAMM00380708|