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Ligand

NameCHEMBL2048171
Molecular formulaC18H16N2O4S
IUPAC name2-[2-[(2-methoxycarbonylphenyl)methylsulfanyl]benzimidazol-1-yl]acetic acid
Molecular weight356.396
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.3
SynonymsBDBM50387220
SCHEMBL5479153
Inchi KeyANSPVIFHKVYHGI-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H16N2O4S/c1-24-17(23)13-7-3-2-6-12(13)11-25-18-19-14-8-4-5-9-15(14)20(18)10-16(21)22/h2-9H,10-11H2,1H3,(H,21,22)
PubChem CID69457082
ChEMBLCHEMBL2048171
IUPHARN/A
BindingDB50387220
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
9835Prostaglandin D2 receptor 2Q9Y5Y4PTGDR2Homo sapiens (Human)395

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