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Ligand

NameCHEMBL377925
Molecular formulaC23H26N2O2
IUPAC name4-(3,3-diphenylpropyl)-5-piperidin-4-yl-1,2-oxazol-3-one
Molecular weight362.473
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP4.1
SynonymsCHEMBL544544
4-(3,3-Diphenyl-propyl)-5-piperidin-4-yl-isoxazol-3-ol; hydrobromide
BDBM50113806
4-(3,3-diphenylpropyl)-5-(4-piperidyl)-3-isoxazolol
Inchi KeyFJADGXRCKLHLAK-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H26N2O2/c26-23-21(22(27-25-23)19-13-15-24-16-14-19)12-11-20(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-10,19-20,24H,11-16H2,(H,25,26)
PubChem CID10406358
ChEMBLN/A
IUPHARN/A
BindingDB50113806
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
79554Gamma-aminobutyric acid type B receptor subunit 1Q9Z0U4Gabbr1Rattus norvegicus (Rat)991

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