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Ligand

NameCHEMBL2385873
Molecular formulaC23H23NO4
IUPAC name[4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethynyl]phenyl]-[(3R)-3-(hydroxymethyl)piperidin-1-yl]methanone
Molecular weight377.44
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.2
SynonymsN/A
Inchi KeyDQQLMLYYHRYJSJ-LJQANCHMSA-N
Inchi IDInChI=1S/C23H23NO4/c25-16-19-2-1-11-24(15-19)23(26)20-8-5-17(6-9-20)3-4-18-7-10-21-22(14-18)28-13-12-27-21/h5-10,14,19,25H,1-2,11-13,15-16H2/t19-/m1/s1
PubChem CID71734228
ChEMBLCHEMBL2385873
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
66541Metabotropic glutamate receptor 3P31422Grm3Rattus norvegicus (Rat)879

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