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Ligand

NameAC1OH8XL
Molecular formulaC20H18N4O3S
IUPAC nameethyl 2-[[2-(6-pyridin-3-ylpyridazin-3-yl)sulfanylacetyl]amino]benzoate
Molecular weight394.449
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP3.0
SynonymsMLS000678504
CHEMBL1579032
MolPort-003-086-686
HMS2728B24
ZINC4358082
[ Show all ]
Inchi KeyAGQODTQVNNSJQQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H18N4O3S/c1-2-27-20(26)15-7-3-4-8-17(15)22-18(25)13-28-19-10-9-16(23-24-19)14-6-5-11-21-12-14/h3-12H,2,13H2,1H3,(H,22,25)
PubChem CID7207361
ChEMBLCHEMBL1579032
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
5122Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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