CFam Chemical Families Database
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You are searching for "CFAMM00445083" in compound.

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CFAM Mol ID CFAMM00445083
Family CFFBM17925 C-C chemokine receptor type 2 ligand (1S,3R)-N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-3-[(3-methyloxan-4-yl)amino]-1-propan-2-ylcyclopentane-1-carboxamide family
Superfamily CFSBM4149 C-C chemokine receptor type 2 and C-C chemokine receptor type 5 Binder Superfamily 2
Class CFCBM420 Class 3470
External ID CHEMBL494542 External Source CHEMBL
PubChem CID 44573609 Functional Category Bioactive
Molecule Name (1S,3R)-N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-3-[(3-hydroxyoxan-4-yl)amino]-1-propan-2-ylcyclopentane-1-carboxamide
IUPAC Name (1S,3R)-N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-3-[(3-hydroxyoxan-4-yl)amino]-1-propan-2-ylcyclopentane-1-carboxamide
Synonyms CHEBI:578333
InChi InChI=1S/C23H30F6N2O3/c1-13(2)21(5-3-17(10-21)31-18-4-6-34-12-19(18)32)20(33)30-11-14-7-15(22(24,25)26)9-16(8-14)23(27,28)29/h7-9,13,17-19,31-32H,3-6,10-12H2,1-2H3,(H,30,33)/t17-,18?,19?,21+/m1/s1
InChiKey LMJUMWUXZFVMGC-HZGZPEGRSA-N
Formula C23H30F6N2O3 Molecular Weight 496.49
Cross Link CHEMBL494542
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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