CFAM Mol ID	CFAMM00400694
Family	CFFBM10249 C-C chemokine receptor type 2 ligand N-[3-amino-5-(trifluoromethyl)phenyl]-N'-[(2S,3S)-1-[(2,4-dimethylphenyl)methylamino]-3-hydroxyhexan-2-yl]propanediamide family
Superfamily	CFSID2071 Acyl-CoA desaturase and Acyl-CoA desaturase 1 Inhibitor CVT-12012 Superfamily
Class	CFCCD120 Class 933
External ID	CHEMBL2018531	External Source	CHEMBL
PubChem CID	11341950	Functional Category	Bioactive
Molecule Name	N-[3-bromo-5-(trifluoromethyl)phenyl]-N'-[(2S,3S)-1-[(2,4-dimethylphenyl)methylamino]-3-hydroxyhexan-2-yl]propanediamide
IUPAC Name	N-[3-bromo-5-(trifluoromethyl)phenyl]-N'-[(2S,3S)-1-[(2,4-dimethylphenyl)methylamino]-3-hydroxyhexan-2-yl]propanediamide
Synonyms	SureCN3370290
InChi	InChI=1S/C25H31BrF3N3O3/c1-4-5-22(33)21(14-30-13-17-7-6-15(2)8-16(17)3)32-24(35)12-23(34)31-20-10-18(25(27,28)29)9-19(26)11-20/h6-11,21-22,30,33H,4-5,12-14H2,1-3H3,(H,31,34)(H,32,35)/t21-,22-/m0/s1
InChiKey	DKIKCGFJJHVGPK-VXKWHMMOSA-N
Formula	C25H31BrF3N3O3	Molecular Weight	558.43
Cross Link	CHEMBL2018531
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

48680 visits since 2014 .........

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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