CFam Chemical Families Database
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You are searching for "CFAMM00212518" 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 CFAMM00212518
Family CFFID500 Interleukin-1 receptor type 1 and Mitogen-activated protein kinase 14 Inhibitor Sb 203580 Family
Superfamily CFSID405 D(2) dopamine receptor and Interleukin-1 receptor type 1 Binder Superfamily
Class CFCCD101 Class 914
External ID CHEMBL1271775 External Source CHEMBL
PubChem CID 52944302 Functional Category Bioactive
Molecule Name AGN-PC-09M6A7
IUPAC Name N-[4-[3-(4-chlorobutyl)-5-(4-fluorophenyl)-2-methylsulfanylimidazol-4-yl]pyridin-2-yl]acetamide
Synonyms CHEBI:811031;N-[4-[3-(4-chlorobutyl)-5-(4-fluorophenyl)-2-methylsulfanylimidazol-4-yl]pyridin-2-yl]acetamide
InChi InChI=1S/C21H22ClFN4OS/c1-14(28)25-18-13-16(9-11-24-18)20-19(15-5-7-17(23)8-6-15)26-21(29-2)27(20)12-4-3-10-22/h5-9,11,13H,3-4,10,12H2,1-2H3,(H,24,25,28)
InChiKey RJYVSMBQEZIIMQ-UHFFFAOYSA-N
Formula C21H22ClFN4OS Molecular Weight 432.94
Cross Link CHEMBL1271775
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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