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Ligand

NameMLS000733663
Molecular formulaC22H17ClN4O
IUPAC name[1-(3-chlorophenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-pyrazin-2-ylmethanone
Molecular weight388.855
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP3.6
Synonyms1-(3-chlorophenyl)-2-(2-pyrazinylcarbonyl)-2,3,4,9-tetrahydro-1H-beta-carboline
1-(3-chlorophenyl)-2-(pyrazin-2-ylcarbonyl)-2,3,4,9-tetrahydro-1H-beta-carboline
CHEMBL1451613
HMS2587P09
MCULE-4110887806
[ Show all ]
Inchi KeyADMPPVXJNBDGHK-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H17ClN4O/c23-15-5-3-4-14(12-15)21-20-17(16-6-1-2-7-18(16)26-20)8-11-27(21)22(28)19-13-24-9-10-25-19/h1-7,9-10,12-13,21,26H,8,11H2
PubChem CID16190931
ChEMBLCHEMBL1451613
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
2421Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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