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Ligand

NameMLS000090902
Molecular formulaC19H21NO4
IUPAC name2-methoxyethyl 3-methyl-4-oxo-6-phenyl-1,5,6,7-tetrahydroindole-2-carboxylate
Molecular weight327.38
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP2.6
Synonyms2-methoxyethyl 3-methyl-4-oxo-6-phenyl-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
SMR000025505
2-methoxyethyl 3-methyl-4-oxo-6-phenyl-1,5,6,7-tetrahydroindole-2-carboxylate
AC1MMJOK
CHEMBL1576132
[ Show all ]
Inchi KeyAQLXIJYAVMSMFH-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H21NO4/c1-12-17-15(20-18(12)19(22)24-9-8-23-2)10-14(11-16(17)21)13-6-4-3-5-7-13/h3-7,14,20H,8-11H2,1-2H3
PubChem CID3239810
ChEMBLCHEMBL1576132
IUPHARN/A
BindingDB31065
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: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
118965-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
118935-hydroxytryptamine receptor 1EP28566HTR1EHomo sapiens (Human)365
11897Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
11894Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371
11895Sphingosine 1-phosphate receptor 3Q99500S1PR3Homo sapiens (Human)378

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