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Ligand

NameCHEMBL3088086
Molecular formulaC29H40NO3+
IUPAC name[(3R)-1-(3-phenoxypropyl)-1-azoniabicyclo[2.2.2]octan-3-yl] 1-cyclopenta-1,3-dien-1-ylcycloheptane-1-carboxylate
Molecular weight450.643
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP6.4
SynonymsBDBM50443280
Inchi KeyAKFPOKNYHMXDIT-ROTRRZJSSA-N
Inchi IDInChI=1S/C29H40NO3/c31-28(29(25-11-6-7-12-25)17-8-1-2-9-18-29)33-27-23-30(20-15-24(27)16-21-30)19-10-22-32-26-13-4-3-5-14-26/h3-7,11,13-14,24,27H,1-2,8-10,12,15-23H2/q+1/t24?,27-,30?/m0/s1
PubChem CID72545526
ChEMBLCHEMBL3088086
IUPHARN/A
BindingDBN/A
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
7494Muscarinic acetylcholine receptor M3P20309CHRM3Homo sapiens (Human)590

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