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Ligand

NameCHEMBL3400282
Molecular formulaC30H37N3O
IUPAC name(1R,2R)-N-[(2S,3S)-2-amino-3-methylpentyl]-N-[4-[4-(methylaminomethyl)phenyl]phenyl]-2-phenylcyclopropane-1-carboxamide
Molecular weight455.646
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP4.9
SynonymsBDBM50065920
Inchi KeyBLWYNZKFLRWKQF-AGMJPXHESA-N
Inchi IDInChI=1S/C30H37N3O/c1-4-21(2)29(31)20-33(30(34)28-18-27(28)25-8-6-5-7-9-25)26-16-14-24(15-17-26)23-12-10-22(11-13-23)19-32-3/h5-17,21,27-29,32H,4,18-20,31H2,1-3H3/t21-,27-,28+,29+/m0/s1
PubChem CID118727691
ChEMBLCHEMBL3400282
IUPHARN/A
BindingDB50065920
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
442716Probable G-protein coupled receptor 88Q9GZN0GPR88Homo sapiens (Human)384

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