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Ligand

NameCHEMBL291896
Molecular formulaC33H32F2N6O5
IUPAC nameethyl 3-[[benzyl(methyl)amino]methyl]-8-[(2,6-difluorophenyl)methyl]-2-[4-(methoxycarbamoylamino)phenyl]-5-oxoimidazo[1,2-a]pyrimidine-6-carboxylate
Molecular weight630.653
Hydrogen bond acceptor10
Hydrogen bond donor2
XlogP4.4
SynonymsBDBM50115995
3-[(Benzyl-methyl-amino)-methyl]-8-(2,6-difluoro-benzyl)-2-[4-(3-methoxy-ureido)-phenyl]-5-oxo-5,8-dihydro-imidazo[1,2-a]pyrimidine-6-carboxylic acid ethyl ester
Inchi KeyARKXMZVKTXQLIR-UHFFFAOYSA-N
Inchi IDInChI=1S/C33H32F2N6O5/c1-4-46-31(43)25-19-40(18-24-26(34)11-8-12-27(24)35)33-37-29(22-13-15-23(16-14-22)36-32(44)38-45-3)28(41(33)30(25)42)20-39(2)17-21-9-6-5-7-10-21/h5-16,19H,4,17-18,20H2,1-3H3,(H2,36,38,44)
PubChem CID44305285
ChEMBLCHEMBL291896
IUPHARN/A
BindingDB50115995
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
12557Gonadotropin-releasing hormone receptorP30968GNRHRHomo sapiens (Human)328

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