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Ligand

NameCHEMBL141736
Molecular formulaC24H29N2O2+
IUPAC name(4aR,5aS,8aS,13aS,15aS,15bR)-6-propyl-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-6-ium-14-one
Molecular weight377.508
Hydrogen bond acceptor2
Hydrogen bond donor0
XlogP2.8
Synonyms19-Propyl-10-oxostrychnidine-19-ium
Inchi KeyABXGTNGUHIUIPP-HWHTXHROSA-N
Inchi IDInChI=1S/C24H29N2O2/c1-2-9-26-10-8-24-17-5-3-4-6-18(17)25-21(27)13-19-22(23(24)25)16(12-20(24)26)15(14-26)7-11-28-19/h3-7,16,19-20,22-23H,2,8-14H2,1H3/q+1/t16-,19-,20-,22-,23-,24+,26?/m0/s1
PubChem CID44358937
ChEMBLCHEMBL141736
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
1277Muscarinic acetylcholine receptor M1P11229CHRM1Homo sapiens (Human)460
1278Muscarinic acetylcholine receptor M2P08172CHRM2Homo sapiens (Human)466
1279Muscarinic acetylcholine receptor M3P20309CHRM3Homo sapiens (Human)590
1276Muscarinic acetylcholine receptor M4P08173CHRM4Homo sapiens (Human)479

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