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Ligand

NameMK-5046
Molecular formulaC20H18F6N4O
IUPAC name(2S)-1,1,1-trifluoro-2-(4-pyrazol-1-ylphenyl)-3-[5-[[1-(trifluoromethyl)cyclopropyl]methyl]-1H-imidazol-2-yl]propan-2-ol
Molecular weight444.381
Hydrogen bond acceptor9
Hydrogen bond donor2
XlogP4.1
Synonyms(S)-2-(4-(1H-pyrazol-1-yl)phenyl)-1,1,1-trifluoro-3-(5-((1-(trifluoromethyl)cyclopropyl)methyl)-1H-imidazol-2-yl)propan-2-ol
BCP23816
KB-333518
SCHEMBL3499662
1H-Imidazole-2-ethanol, a-[4-(1H-pyrazol-1-yl)phenyl]-a-(trifluoromethyl)-5-[[1-(trifluoromethyl)cyclopropyl]methyl]-, (aS)-;1H-Imidazole-2-ethanol, a-[4-(1H-pyrazol-1-yl)phenyl]-a-(trifluoromethyl)-5-[[1-(trifluoromethyl)cyclopropyl]methyl]-, (aS)-
[ Show all ]
Inchi KeyUJINBEQCDMOAHM-SFHVURJKSA-N
Inchi IDInChI=1S/C20H18F6N4O/c21-19(22,23)17(6-7-17)10-14-12-27-16(29-14)11-18(31,20(24,25)26)13-2-4-15(5-3-13)30-9-1-8-28-30/h1-5,8-9,12,31H,6-7,10-11H2,(H,27,29)/t18-/m0/s1
PubChem CID49871766
ChEMBLCHEMBL1672354
IUPHAR6170
BindingDB50336889
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
338192Bombesin receptor subtype-3O54798Brs3Mus musculus (Mouse)399
338193Bombesin receptor subtype-3Q8K418Brs3Rattus norvegicus (Rat)399
338194Bombesin receptor subtype-3P32247BRS3Homo sapiens (Human)399
554960Gastrin-releasing peptide receptorP30550GRPRHomo sapiens (Human)384
554959Neuromedin-B receptorP28336NMBRHomo sapiens (Human)390

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