CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00246196" 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.

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CFAM Mol ID CFAMM00246196
Family CFFID1684 Adenosine receptor A1 and Adenosine receptor A3 Ligand 2-(4-methoxyphenyl)-6-phenyl-9h-purine Family
Superfamily CFSCD144 Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform Inhibitor TG100-115 Superfamily
Class CFCCD118 Class 931
External ID CHEMBL143986 External Source CHEMBL
PubChem CID 9844744 Functional Category Bioactive
Molecule Name SureCN1028739
IUPAC Name N-(4-phenoxyphenyl)-4-(7H-purin-6-yl)piperazine-1-carboxamide
Synonyms SureCN1028741;CHEBI:342566
InChi InChI=1S/C22H21N7O2/c30-22(27-16-6-8-18(9-7-16)31-17-4-2-1-3-5-17)29-12-10-28(11-13-29)21-19-20(24-14-23-19)25-15-26-21/h1-9,14-15H,10-13H2,(H,27,30)(H,23,24,25,26)
InChiKey VJQWZMWCEAGZMO-UHFFFAOYSA-N
Formula C22H21N7O2 Molecular Weight 415.45
Cross Link CHEMBL143986
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
 

 

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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