CFAM Mol ID	CFAMM00437400
Family	CFFBM16215 Gonadotropin-releasing hormone receptor ligand 3-[(2R)-2-amino-2-phenylethyl]-1-[[2-fluoro-6-(2-hydroxyethylsulfonyl)phenyl]methyl]-5-(2-fluoro-3-methoxyphenyl)pyrimidine-2,4-dione family
Superfamily	CFSBM6794 Muscleblind-like protein 1 and Inositol monophosphatase 1 Binder Superfamily
Class	CFCCD41 Class 854
External ID	CHEMBL453167	External Source	CHEMBL
PubChem CID	44576680	Functional Category	Bioactive
Molecule Name	4-[[(1R)-2-[5-(2-fluoro-3-methoxyphenyl)-3-[(2-fluoro-6-methylsulfonylphenyl)methyl]-2,6-dioxopyrimidin-1-yl]-1-phenylethyl]amino]butanoic acid
IUPAC Name	4-[[(1R)-2-[5-(2-fluoro-3-methoxyphenyl)-3-[(2-fluoro-6-methylsulfonylphenyl)methyl]-2,6-dioxopyrimidin-1-yl]-1-phenylethyl]amino]butanoic acid
Synonyms	CHEBI:586326
InChi	InChI=1S/C31H31F2N3O7S/c1-43-26-13-6-11-21(29(26)33)22-17-35(18-23-24(32)12-7-14-27(23)44(2,41)42)31(40)36(30(22)39)19-25(20-9-4-3-5-10-20)34-16-8-15-28(37)38/h3-7,9-14,17,25,34H,8,15-16,18-19H2,1-2H3,(H,37,38)/t25-/m0/s1
InChiKey	JELUMXNSIYVRCU-VWLOTQADSA-N
Formula	C31H31F2N3O7S	Molecular Weight	627.66
Cross Link	CHEMBL453167
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

48709 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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