CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00404273" 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 CFAMM00404273
Family CFFBM10765 Cannabinoid receptor 2 ligand 8-(2-chlorophenyl)-9-cyclopropyl-2-methyl-6-(4-methylpiperazin-1-yl)purine family
Superfamily CFSID1649 Proto-oncogene tyrosine-protein kinase Src Inhibitor BMS-279700 Superfamily
Class CFCID907 Class 2257
External ID CHEMBL51353 External Source CHEMBL
PubChem CID 10714900 Functional Category Bioactive
Molecule Name 1-[2-[6-amino-8-(4-chlorophenyl)-9-methylpurin-2-yl]ethynyl]cyclohexan-1-ol
IUPAC Name 1-[2-[6-amino-8-(4-chlorophenyl)-9-methylpurin-2-yl]ethynyl]cyclohexan-1-ol
Synonyms CHEBI:177069
InChi InChI=1S/C20H20ClN5O/c1-26-18(13-5-7-14(21)8-6-13)25-16-17(22)23-15(24-19(16)26)9-12-20(27)10-3-2-4-11-20/h5-8,27H,2-4,10-11H2,1H3,(H2,22,23,24)
InChiKey LFMWMGADNPPIMY-UHFFFAOYSA-N
Formula C20H20ClN5O Molecular Weight 381.86
Cross Link CHEMBL51353
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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