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Ligand

NameCHEMBL111933
Molecular formulaC29H28F3N3O3
IUPAC name1-[(2,6-difluorophenyl)methyl]-3-[(2R)-1-[(3-fluorophenyl)methylamino]propan-2-yl]-5-(3-methoxyphenyl)-6-methylpyrimidine-2,4-dione
Molecular weight523.556
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP4.7
Synonyms1-(2,6-Difluorobenzyl)-3-[(R)-1-methyl-2-(3-fluorobenzylamino)ethyl]-5-(3-methoxyphenyl)-6-methyluracil
1-(2,6-Difluoro-benzyl)-3-[(R)-2-(3-fluoro-benzylamino)-1-methyl-ethyl]-5-(3-methoxy-phenyl)-6-methyl-1H-pyrimidine-2,4-dione
BDBM50132749
Inchi KeyBNVVTOQKKGNWTP-GOSISDBHSA-N
Inchi IDInChI=1S/C29H28F3N3O3/c1-18(15-33-16-20-7-4-9-22(30)13-20)35-28(36)27(21-8-5-10-23(14-21)38-3)19(2)34(29(35)37)17-24-25(31)11-6-12-26(24)32/h4-14,18,33H,15-17H2,1-3H3/t18-/m1/s1
PubChem CID44340824
ChEMBLCHEMBL111933
IUPHARN/A
BindingDB50132749
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
28481Gonadotropin-releasing hormone receptorP30968GNRHRHomo sapiens (Human)328

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