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Ligand

NameCHEMBL3403777
Molecular formulaC23H32N2O3
IUPAC name(2S)-N-[(1R)-2-hydroxy-1-[4-(2-methylpentoxy)phenyl]ethyl]-2-(methylamino)-2-phenylacetamide
Molecular weight384.52
Hydrogen bond acceptor4
Hydrogen bond donor3
XlogP3.9
SynonymsBDBM50064748
Inchi KeyJLTAEUZQZRMWSH-VNQANMTISA-N
Inchi IDInChI=1S/C23H32N2O3/c1-4-8-17(2)16-28-20-13-11-18(12-14-20)21(15-26)25-23(27)22(24-3)19-9-6-5-7-10-19/h5-7,9-14,17,21-22,24,26H,4,8,15-16H2,1-3H3,(H,25,27)/t17?,21-,22-/m0/s1
PubChem CID118730005
ChEMBLCHEMBL3403777
IUPHARN/A
BindingDB50064748
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
447778Probable G-protein coupled receptor 88Q9GZN0GPR88Homo sapiens (Human)384

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