CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00158999" 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 CFAMM00158999
Family CFFCD464 5-hydroxytryptamine receptor 1A and D(2) dopamine receptor Ligand PD-158771 Family
Superfamily CFSCD424 5-hydroxytryptamine receptor 1A and D(2) dopamine receptor Ligand PD-158771 Superfamily
Class CFCCD305 Class 1118
External ID CHEMBL165056 External Source CHEMBL
PubChem CID 10765237 Functional Category Bioactive
Molecule Name SureCN8470564
IUPAC Name N-[4-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]cyclohexyl]pyrimidin-2-amine
Synonyms SureCN8473689;CHEBI:374597
InChi InChI=1S/C23H30F3N5/c24-23(25,26)19-3-1-4-21(17-19)31-15-13-30(14-16-31)12-9-18-5-7-20(8-6-18)29-22-27-10-2-11-28-22/h1-4,10-11,17-18,20H,5-9,12-16H2,(H,27,28,29)/t18-,20-
InChiKey CHELUMIQBPPRGN-KESTWPANSA-N
Formula C23H30F3N5 Molecular Weight 433.51
Cross Link CHEMBL165056
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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