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Ligand

NameCHEMBL3322503
Molecular formulaC24H22N2O6S
IUPAC name2-[5-(1,3-dioxobenzo[de]isoquinolin-2-yl)pentylsulfamoyl]benzoic acid
Molecular weight466.508
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP3.4
SynonymsBDBM50056348
SCHEMBL15490696
Inchi KeyNAPRNXJZZCBCEH-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H22N2O6S/c27-22-18-11-6-8-16-9-7-12-19(21(16)18)23(28)26(22)15-5-1-4-14-25-33(31,32)20-13-3-2-10-17(20)24(29)30/h2-3,6-13,25H,1,4-5,14-15H2,(H,29,30)
PubChem CID73296094
ChEMBLCHEMBL3322503
IUPHARN/A
BindingDB50056348
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
450306Lysophosphatidic acid receptor 2Q9HBW0LPAR2Homo sapiens (Human)351

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