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Ligand

NameCHEMBL3403768
Molecular formulaC23H31NO3
IUPAC name(2S)-N-[(1R)-2-hydroxy-1-[4-(2-methylpentoxy)phenyl]ethyl]-2-phenylpropanamide
Molecular weight369.505
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP4.8
Synonyms(2S)-N-((1R)-2-hydroxy-1-(4-(2-methylpentyloxy)phenyl)ethyl)-2-phenylpropanamide
SCHEMBL2523748
BDBM50064645
GXJPLTPOMVKXAT-RBENRJQXSA-N
(2S)-N-[(R)-alpha-(Hydroxymethyl)-4-(2-methylpentoxy)benzyl]-2-phenylpropanamide
[ Show all ]
Inchi KeyGXJPLTPOMVKXAT-RBENRJQXSA-N
Inchi IDInChI=1S/C23H31NO3/c1-4-8-17(2)16-27-21-13-11-20(12-14-21)22(15-25)24-23(26)18(3)19-9-6-5-7-10-19/h5-7,9-14,17-18,22,25H,4,8,15-16H2,1-3H3,(H,24,26)/t17?,18-,22-/m0/s1
PubChem CID51356430
ChEMBLCHEMBL3403768
IUPHARN/A
BindingDB50064645
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
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GLASS IDNameUniProtGeneSpeciesLength
445955Probable G-protein coupled receptor 88Q9GZN0GPR88Homo sapiens (Human)384

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