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Ligand

NameMLS000735317
Molecular formulaC22H19N3OS
IUPAC name1-(1-pyridin-2-yl-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-thiophen-3-ylethanone
Molecular weight373.474
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP3.4
Synonyms1-(1-pyridin-2-yl-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-thiophen-3-yl-ethanone
1-(1-pyridin-2-yl-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-thiophen-3-ylethanone
1-pyridin-2-yl-2-(3-thienylacetyl)-2,3,4,9-tetrahydro-1H-beta-carboline
1-[1-(2-pyridinyl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-2-(3-thiophenyl)ethanone
1-[1-(2-pyridyl)-1,3,4,9-tetrahydro-beta-carbolin-2-yl]-2-(3-thienyl)ethanone
[ Show all ]
Inchi KeyABRGOYYTYJJEHV-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H19N3OS/c26-20(13-15-9-12-27-14-15)25-11-8-17-16-5-1-2-6-18(16)24-21(17)22(25)19-7-3-4-10-23-19/h1-7,9-10,12,14,22,24H,8,11,13H2
PubChem CID16187326
ChEMBLCHEMBL1577277
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
1098Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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