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Ligand

NameCHEMBL502182
Molecular formulaC32H29F5N3O5-
IUPAC name4-[[(1R)-2-[5-(2-fluoro-3-methoxyphenyl)-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-4-methyl-2,6-dioxopyrimidin-1-yl]-1-phenylethyl]amino]butanoate
Molecular weight630.592
Hydrogen bond acceptor11
Hydrogen bond donor1
XlogP3.3
Synonyms(R)-4-{2-[5-(2-Fluoro-3-methoxyphenyl)-3-(2-fluoro-6-[trifluoromethyl]benzyl)-2,6-dioxo-3,6-dihydro-2H-pyrimidin-1-yl]-1-phenylethylamino}butyric Acid Sodium Salt
BDBM50274930
Inchi KeyHEAUOKZIVMZVQL-VWLOTQADSA-M
Inchi IDInChI=1S/C32H30F5N3O5/c1-19-28(21-11-6-14-26(45-2)29(21)34)30(43)40(18-25(20-9-4-3-5-10-20)38-16-8-15-27(41)42)31(44)39(19)17-22-23(32(35,36)37)12-7-13-24(22)33/h3-7,9-14,25,38H,8,15-18H2,1-2H3,(H,41,42)/p-1/t25-/m0/s1
PubChem CID91934928
ChEMBLN/A
IUPHARN/A
BindingDB50274930
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 10 hydrogen bond acceptor.
This ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
112537Gonadotropin-releasing hormone receptorP30968GNRHRHomo sapiens (Human)328
112538Gonadotropin-releasing hormone receptorP30969GnrhrRattus norvegicus (Rat)327
460236Gonadotropin-releasing hormone receptorQ8SPZ1GNRHRMacaca mulatta (Rhesus macaque)59

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