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Ligand

NameCHEMBL2048166
Molecular formulaC17H16N2O2S
IUPAC name2-[2-[(2-methylphenyl)methylsulfanyl]benzimidazol-1-yl]acetic acid
Molecular weight312.387
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.8
SynonymsBDBM50387226
Inchi KeyAFOPLMGCZZFTDN-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H16N2O2S/c1-12-6-2-3-7-13(12)11-22-17-18-14-8-4-5-9-15(14)19(17)10-16(20)21/h2-9H,10-11H2,1H3,(H,20,21)
PubChem CID70682001
ChEMBLCHEMBL2048166
IUPHARN/A
BindingDB50387226
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
4358Prostaglandin D2 receptor 2Q9Y5Y4PTGDR2Homo sapiens (Human)395

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