CFam Chemical Families Database
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You are searching for "CFAMM00481151" in compound.

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CFAM Mol ID CFAMM00481151
Family CFFBM27032 C-C chemokine receptor type 3 ligand 4-[[2-(4-chlorophenyl)ethyl-[1-(2,6-difluorobenzoyl)piperidin-4-yl]amino]methyl]-2-[4-(dimethylamino)phenyl]-1,5-dimethylpyrazol-3-one family
Superfamily CFSBM6888 C-C chemokine receptor type 3 Binder Superfamily
Class CFCCD10 Class 823
External ID CHEMBL246346 External Source CHEMBL
PubChem CID 44440419 Functional Category Bioactive
Molecule Name 4-[4-[[2-(4-chlorophenyl)ethyl-[1-(2,6-difluorobenzoyl)piperidin-4-yl]amino]methyl]-2,3-dimethyl-5-oxopyrazol-1-yl]benzonitrile
IUPAC Name 4-[4-[[2-(4-chlorophenyl)ethyl-[1-(2,6-difluorobenzoyl)piperidin-4-yl]amino]methyl]-2,3-dimethyl-5-oxopyrazol-1-yl]benzonitrile
Synonyms CHEBI:511149
InChi InChI=1S/C33H32ClF2N5O2/c1-22-28(32(42)41(38(22)2)27-12-8-24(20-37)9-13-27)21-40(17-14-23-6-10-25(34)11-7-23)26-15-18-39(19-16-26)33(43)31-29(35)4-3-5-30(31)36/h3-13,26H,14-19,21H2,1-2H3
InChiKey MPHCOQSUJSBYCJ-UHFFFAOYSA-N
Formula C33H32ClF2N5O2 Molecular Weight 604.09
Cross Link CHEMBL246346
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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