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Ligand

NameCHEMBL1778639
Molecular formulaC18H17F3O5S
IUPAC name2-[2-(4-ethylsulfonyl-2-methylphenyl)-4-(trifluoromethyl)phenoxy]acetic acid
Molecular weight402.384
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP4.0
Synonyms2-(4''-(ethylsulfonyl)-2''-methyl-5-(trifluoromethyl)biphenyl-2-yloxy)acetic acid
BDBM50344991
SCHEMBL1690240
Inchi KeyKDOSMMYSHYZFQE-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H17F3O5S/c1-3-27(24,25)13-5-6-14(11(2)8-13)15-9-12(18(19,20)21)4-7-16(15)26-10-17(22)23/h4-9H,3,10H2,1-2H3,(H,22,23)
PubChem CID53359023
ChEMBLCHEMBL1778639
IUPHARN/A
BindingDB50344991
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
166562Prostaglandin D2 receptor 2Q9Y5Y4PTGDR2Homo sapiens (Human)395
166563Prostaglandin D2 receptor 2Q9Z2J6Ptgdr2Mus musculus (Mouse)382
166564Prostaglandin D2 receptor 2Q6XKD3Ptgdr2Rattus norvegicus (Rat)403

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