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Ligand

NameCHEMBL3685835
Molecular formulaC23H20ClN3O4
IUPAC name2-[1-[[4-(1-benzofuran-2-carbonylamino)-2-chlorophenyl]methyl]-3,5-dimethylpyrazol-4-yl]acetic acid
Molecular weight437.88
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP4.3
SynonymsUS8759386, 5
BDBM124808
SCHEMBL15808682
Inchi KeyAOSSVPQNGRXRTR-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H20ClN3O4/c1-13-18(11-22(28)29)14(2)27(26-13)12-16-7-8-17(10-19(16)24)25-23(30)21-9-15-5-3-4-6-20(15)31-21/h3-10H,11-12H2,1-2H3,(H,25,30)(H,28,29)
PubChem CID59054506
ChEMBLCHEMBL3685835
IUPHARN/A
BindingDB124808
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
10570Prostaglandin D2 receptor 2Q9Y5Y4PTGDR2Homo sapiens (Human)395

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