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Ligand

Name690249-56-0
Molecular formulaC17H14N4O2S
IUPAC name2-[3-(1H-1,2,4-triazol-5-ylsulfanyl)propyl]benzo[de]isoquinoline-1,3-dione
Molecular weight338.385
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.1
SynonymsCBKinase1_011570
CBKinase1_023970
AC1MG77U
MLS000679886
CHEMBL1505945
[ Show all ]
Inchi KeyACUPQPGUHKDMKN-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H14N4O2S/c22-15-12-6-1-4-11-5-2-7-13(14(11)12)16(23)21(15)8-3-9-24-17-18-10-19-20-17/h1-2,4-7,10H,3,8-9H2,(H,18,19,20)
PubChem CID2981635
ChEMBLCHEMBL1505945
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
1949Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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