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Ligand

NameMLS001150481
Molecular formulaC18H18BrFN2O4S
IUPAC name(4-bromo-2-fluorophenyl) 3-(4-methylpiperazin-1-yl)sulfonylbenzoate
Molecular weight457.314
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP3.1
SynonymsCHEMBL1331863
MolPort-005-736-196
HMS2984C05
ZINC15925009
AKOS034111135
[ Show all ]
Inchi KeyACQKXGNAJXOIRM-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H18BrFN2O4S/c1-21-7-9-22(10-8-21)27(24,25)15-4-2-3-13(11-15)18(23)26-17-6-5-14(19)12-16(17)20/h2-6,11-12H,7-10H2,1H3
PubChem CID24819894
ChEMBLCHEMBL1331863
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
1797Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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