CFam Chemical Families Database
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You are searching for "CFAMM00425832" in compound.

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CFAM Mol ID CFAMM00425832
Family CFFBM14039 C-X-C chemokine receptor type 3 ligand AGN-PC-07CQOB family
Superfamily CFSBM6228 C-X-C chemokine receptor type 3 Binder Superfamily 2
Class CFCBM1871 Class 4921
External ID CHEMBL272720 External Source CHEMBL
PubChem CID 44455568 Functional Category Bioactive
Molecule Name N-[(1R)-1-[1-(4-cyanophenyl)-4-pyridin-3-ylimidazol-2-yl]ethyl]-N-(2-ethylsulfonylethyl)-2-[4-fluoro-3-(trifluoromethyl)phenyl]acetamide
IUPAC Name N-[(1R)-1-[1-(4-cyanophenyl)-4-pyridin-3-ylimidazol-2-yl]ethyl]-N-(2-ethylsulfonylethyl)-2-[4-fluoro-3-(trifluoromethyl)phenyl]acetamide
Synonyms SureCN13151140
InChi InChI=1S/C30H27F4N5O3S/c1-3-43(41,42)14-13-38(28(40)16-22-8-11-26(31)25(15-22)30(32,33)34)20(2)29-37-27(23-5-4-12-36-18-23)19-39(29)24-9-6-21(17-35)7-10-24/h4-12,15,18-20H,3,13-14,16H2,1-2H3/t20-/m1/s1
InChiKey VWBXKWIZHKCIDZ-HXUWFJFHSA-N
Formula C30H27F4N5O3S Molecular Weight 613.63
Cross Link CHEMBL272720
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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