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Ligand

NameCHEMBL3322514
Molecular formulaC23H19ClN2O6S
IUPAC name5-chloro-2-[4-(1,3-dioxobenzo[de]isoquinolin-2-yl)butylsulfamoyl]benzoic acid
Molecular weight486.923
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP3.7
SynonymsBDBM50056344
2-[[4-(1,3-Dioxo-1,3-dihydro-2H-benzo[de]isoquinoline-2-yl)butyl]sulfamoyl]-5-chlorobenzoic acid
Inchi KeyOVJUYQCJIFWMBI-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H19ClN2O6S/c24-15-9-10-19(18(13-15)23(29)30)33(31,32)25-11-1-2-12-26-21(27)16-7-3-5-14-6-4-8-17(20(14)16)22(26)28/h3-10,13,25H,1-2,11-12H2,(H,29,30)
PubChem CID77461257
ChEMBLCHEMBL3322514
IUPHARN/A
BindingDB50056344
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
451615Lysophosphatidic acid receptor 2Q9HBW0LPAR2Homo sapiens (Human)351

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