CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00227132" 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 CFAMM00227132
Family CFFID1082 Adenosine receptor A1 and Adenosine receptor A2a Ligand 2,6-diphenyl-8-(1-ethylpropyl)-1-deazapurine Family
Superfamily CFSID139 Tryptase and Adenosine receptor A1 Binder Superfamily
Class CFCAD667 Class 667
External ID CHEMBL383130 External Source CHEMBL
PubChem CID 11640419 Functional Category Bioactive
Molecule Name AGN-PC-00D7RN
IUPAC Name 8-cyclohexyl-6-(3,4-dichlorophenyl)-2-phenyl-7H-purine
Synonyms 8-cyclohexyl-6-(3,4-dichlorophenyl)-2-phenyl-7H-purine;CHEBI:446419
InChi InChI=1S/C23H20Cl2N4/c24-17-12-11-16(13-18(17)25)19-20-23(28-21(26-19)14-7-3-1-4-8-14)29-22(27-20)15-9-5-2-6-10-15/h1,3-4,7-8,11-13,15H,2,5-6,9-10H2,(H,26,27,28,29)
InChiKey XPWCKGZFGSNHOU-UHFFFAOYSA-N
Formula C23H20Cl2N4 Molecular Weight 423.34
Cross Link CHEMBL383130
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
 

 

26223 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', 'CFAMM00227132'),None, txtsearch, CFAMM00227132|