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Ligand

NameMLS001157382
Molecular formulaC19H23BrN2O2S
IUPAC name2-(4-bromophenyl)sulfanyl-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]acetamide
Molecular weight423.369
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.0
SynonymsCHEMBL1325694
MolPort-009-491-882
HMS3035B16
AKOS016861274
MCULE-9284934712
[ Show all ]
Inchi KeyAAUKJULPRYSWBM-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H23BrN2O2S/c20-15-6-8-16(9-7-15)25-14-19(23)21-13-17(18-5-4-12-24-18)22-10-2-1-3-11-22/h4-9,12,17H,1-3,10-11,13-14H2,(H,21,23)
PubChem CID24983016
ChEMBLCHEMBL1325694
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
554Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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