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Ligand

NameCHEMBL543125
Molecular formulaC23H22N2O2
IUPAC name4-(anthracen-9-ylmethyl)-5-piperidin-4-yl-1,2-oxazol-3-one
Molecular weight358.441
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP4.3
SynonymsCHEMBL359417
4-(9-Anthrylmethyl)-5-(4-piperidinyl)isoxazole-3-ol
BDBM50113804
4-Anthracen-9-ylmethyl-5-piperidin-4-yl-isoxazol-3-ol; hydrobromide
Inchi KeyNUSNKEBTPCBSNA-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H22N2O2/c26-23-21(22(27-25-23)15-9-11-24-12-10-15)14-20-18-7-3-1-5-16(18)13-17-6-2-4-8-19(17)20/h1-8,13,15,24H,9-12,14H2,(H,25,26)
PubChem CID10666107
ChEMBLN/A
IUPHARN/A
BindingDB50113804
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
232631Gamma-aminobutyric acid type B receptor subunit 1Q9Z0U4Gabbr1Rattus norvegicus (Rat)991

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