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Ligand

Name3-Quinuclidinyl benzilate
Molecular formulaC21H23NO3
IUPAC name1-azabicyclo[2.2.2]octan-3-yl 2-hydroxy-2,2-diphenylacetate
Molecular weight337.419
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.3
Synonyms1-Azabicyclo[2.2.2]oct-3-yl hydroxy(diphenyl)acetate #
3-Quinuclidinol, benzilate (ester)
581Q062
Benzeneacetic acid, 1-azabicyclo[2.2.2]oct-3-yl ester
GTPL318
[ Show all ]
Inchi KeyHGMITUYOCPPQLE-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H23NO3/c23-20(25-19-15-22-13-11-16(19)12-14-22)21(24,17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-10,16,19,24H,11-15H2
PubChem CID23056
ChEMBLCHEMBL12980
IUPHAR318
BindingDB50010096
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: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
114238Muscarinic acetylcholine receptor DM1P16395mAChR-ADrosophila melanogaster (Fruit fly)805
114241Muscarinic acetylcholine receptor M1P11229CHRM1Homo sapiens (Human)460
114237Muscarinic acetylcholine receptor M2P10980Chrm2Rattus norvegicus (Rat)466
114240Muscarinic acetylcholine receptor M2P08172CHRM2Homo sapiens (Human)466
553828Muscarinic acetylcholine receptor M3P20309CHRM3Homo sapiens (Human)590
553829Muscarinic acetylcholine receptor M4P08173CHRM4Homo sapiens (Human)479

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