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Ligand

NameCHEMBL3932738
Molecular formulaC30H32NO4+
IUPAC name[(3R)-1-(3-phenoxypropyl)-1-azoniabicyclo[2.2.2]octan-3-yl] 9H-xanthene-9-carboxylate
Molecular weight470.589
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP5.7
SynonymsBDBM228863
US9333195, 128
Inchi KeyAJSGCAGLYFFWMH-JHHOKDCISA-N
Inchi IDInChI=1S/C30H32NO4/c32-30(29-24-11-4-6-13-26(24)34-27-14-7-5-12-25(27)29)35-28-21-31(18-15-22(28)16-19-31)17-8-20-33-23-9-2-1-3-10-23/h1-7,9-14,22,28-29H,8,15-21H2/q+1/t22?,28-,31?/m0/s1
PubChem CID127053833
ChEMBLCHEMBL3932738
IUPHARN/A
BindingDB228863
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
533936Muscarinic acetylcholine receptor M3P20309CHRM3Homo sapiens (Human)590

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