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Ligand

NameCHEMBL312739
Molecular formulaC24H26N2O2
IUPAC name3-(4-benzylphenyl)-1-[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]-1-methylurea
Molecular weight374.484
Hydrogen bond acceptor2
Hydrogen bond donor2
XlogP4.3
Synonyms1-[(1R,2S)-2-Phenyl-2-hydroxy-1-methylethyl]-1-methyl-3-(4-benzylphenyl)urea
Inchi KeyBQUANDATTWVMSL-WZONZLPQSA-N
Inchi IDInChI=1S/C24H26N2O2/c1-18(23(27)21-11-7-4-8-12-21)26(2)24(28)25-22-15-13-20(14-16-22)17-19-9-5-3-6-10-19/h3-16,18,23,27H,17H2,1-2H3,(H,25,28)/t18-,23-/m1/s1
PubChem CID11760542
ChEMBLCHEMBL312739
IUPHARN/A
BindingDBN/A
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
30651Neuropeptide Y receptor type 5Q15761NPY5RHomo sapiens (Human)445

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