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Ligand

NameCHEMBL184684
Molecular formulaC26H21NO6
IUPAC name2-[1-[4-(1,3-benzodioxol-2-ylmethoxy)benzoyl]-2-methylindol-4-yl]acetic acid
Molecular weight443.455
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.9
Synonyms{1-[4-(Benzo[1,3]dioxol-2-ylmethoxy)-benzoyl]-2-methyl-1H-indol-4-yl}-acetic acid
BDBM50152516
SCHEMBL5851218
Inchi KeyNGFCHDLVALKPTJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H21NO6/c1-16-13-20-18(14-24(28)29)5-4-6-21(20)27(16)26(30)17-9-11-19(12-10-17)31-15-25-32-22-7-2-3-8-23(22)33-25/h2-13,25H,14-15H2,1H3,(H,28,29)
PubChem CID21974328
ChEMBLCHEMBL184684
IUPHARN/A
BindingDB50152516
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: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
222576Prostaglandin D2 receptorQ13258PTGDRHomo sapiens (Human)359
222577Prostaglandin D2 receptorP70263PtgdrMus musculus (Mouse)357
222579Prostaglandin E2 receptor EP1 subtypeP35375Ptger1Mus musculus (Mouse)405
222575Prostaglandin E2 receptor EP2 subtypeQ62053Ptger2Mus musculus (Mouse)362
222578Prostaglandin E2 receptor EP3 subtypeP30557Ptger3Mus musculus (Mouse)365
222580Prostaglandin E2 receptor EP4 subtypeP32240Ptger4Mus musculus (Mouse)513

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