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Ligand

NameLY86057
Molecular formulaC20H26N2O3
IUPAC name3-hydroxybutan-2-yl 7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxylate
Molecular weight342.439
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP2.4
SynonymsBDBM84935
GTPL184
3-hydroxybutan-2-yl 6-methyl-6,11-diazatetracyclo[7.6.1.0^{2,7}.0^{12,16}]hexadeca-1(16),9,12,14-tetraene-4-carboxylate
CHEMBL52422
LY 86057
[ Show all ]
Inchi KeyGOHDSZGHAHFEHG-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H26N2O3/c1-11(23)12(2)25-20(24)14-7-16-15-5-4-6-17-19(15)13(9-21-17)8-18(16)22(3)10-14/h4-6,9,11-12,14,16,18,21,23H,7-8,10H2,1-3H3
PubChem CID13878025
ChEMBLN/A
IUPHAR184
BindingDB84935
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: 7
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
1012075-hydroxytryptamine receptor 2AP50129HTR2ASus scrofa (Pig)470
1012105-hydroxytryptamine receptor 2AP50128HTR2AMacaca mulatta (Rhesus macaque)471
5537565-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
5537575-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471
1012065-hydroxytryptamine receptor 2BP30994Htr2bRattus norvegicus (Rat)479
1012095-hydroxytryptamine receptor 2BP41595HTR2BHomo sapiens (Human)481
1012085-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458

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