CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00235730" 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 CFAMM00235730
Family CFFID1321 D(2) dopamine receptor and D(3) dopamine receptor Ligand Azaperone Family
Superfamily CFSID1055 D(2) dopamine receptor and D(3) dopamine receptor Ligand Azaperone Superfamily
Class CFCCD340 Class 1153
External ID CHEMBL141455 External Source CHEMBL
PubChem CID 9977829 Functional Category Bioactive
Molecule Name 4-[4-(5-fluoro-4-methylsulfanylpyrimidin-2-yl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one
IUPAC Name 4-[4-(5-fluoro-4-methylsulfanylpyrimidin-2-yl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one
Synonyms CHEBI:332292
InChi InChI=1S/C19H22F2N4OS/c1-27-18-16(21)13-22-19(23-18)25-11-9-24(10-12-25)8-2-3-17(26)14-4-6-15(20)7-5-14/h4-7,13H,2-3,8-12H2,1H3
InChiKey TVZQYADMEATGII-UHFFFAOYSA-N
Formula C19H22F2N4OS Molecular Weight 392.47
Cross Link CHEMBL141455
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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