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Ligand

NameMLS000948115
Molecular formulaC22H24N4OS
IUPAC nameN-(3-methylphenyl)-2-(3-piperidin-1-ylquinoxalin-2-yl)sulfanylacetamide
Molecular weight392.521
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.6
SynonymsMCULE-5637917548
N-(3-methylphenyl)-2-[(3-piperidin-1-ylquinoxalin-2-yl)thio]acetamide
KSC-15-016
ZINC6721225
AB00863379-09
[ Show all ]
Inchi KeyADPLFXGPKNUCGV-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H24N4OS/c1-16-8-7-9-17(14-16)23-20(27)15-28-22-21(26-12-5-2-6-13-26)24-18-10-3-4-11-19(18)25-22/h3-4,7-11,14H,2,5-6,12-13,15H2,1H3,(H,23,27)
PubChem CID16956475
ChEMBLCHEMBL1474542
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
2938Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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