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Ligand

NameCHEMBL292964
Molecular formulaC23H32O6S
IUPAC name4-[2-[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxy-4-[3-(methoxymethyl)phenyl]but-1-enyl]-5-oxocyclopentyl]ethylsulfanyl]butanoic acid
Molecular weight436.563
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogP1.5
SynonymsONO-AE1-437
D03YAS
GTPL8541
SCHEMBL2306273
BDBM50101858
[ Show all ]
Inchi KeyORSJUPRAHPZYRL-XHTUOEPPSA-N
Inchi IDInChI=1S/C23H32O6S/c1-29-15-17-5-2-4-16(12-17)13-18(24)7-8-19-20(22(26)14-21(19)25)9-11-30-10-3-6-23(27)28/h2,4-5,7-8,12,18-21,24-25H,3,6,9-11,13-15H2,1H3,(H,27,28)/b8-7+/t18-,19-,20-,21-/m1/s1
PubChem CID9824353
ChEMBLCHEMBL292964
IUPHAR8541
BindingDB50101858
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
248821Prostacyclin receptorP43119PTGIRHomo sapiens (Human)386
248817Prostaglandin E2 receptor EP1 subtypeP35375Ptger1Mus musculus (Mouse)405
248819Prostaglandin E2 receptor EP2 subtypeQ62053Ptger2Mus musculus (Mouse)362
248816Prostaglandin E2 receptor EP3 subtypeP30557Ptger3Mus musculus (Mouse)365
248818Prostaglandin E2 receptor EP4 subtypeP32240Ptger4Mus musculus (Mouse)513
248820Prostaglandin E2 receptor EP4 subtypeP43114Ptger4Rattus norvegicus (Rat)488

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