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Ligand

NameCHEMBL3400221
Molecular formulaC28H30F2N2O
IUPAC name(1R,2R)-N-[(2S,3S)-2-amino-3-methylpentyl]-2-(3,5-difluorophenyl)-N-(4-phenylphenyl)cyclopropane-1-carboxamide
Molecular weight448.558
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP5.8
SynonymsBDBM50065728
Inchi KeyBZNWOCZTGXLFFB-NNSXXJBVSA-N
Inchi IDInChI=1S/C28H30F2N2O/c1-3-18(2)27(31)17-32(24-11-9-20(10-12-24)19-7-5-4-6-8-19)28(33)26-16-25(26)21-13-22(29)15-23(30)14-21/h4-15,18,25-27H,3,16-17,31H2,1-2H3/t18-,25-,26+,27+/m0/s1
PubChem CID118727630
ChEMBLCHEMBL3400221
IUPHARN/A
BindingDB50065728
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
443137Probable G-protein coupled receptor 88Q9GZN0GPR88Homo sapiens (Human)384

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