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Ligand

NameCHEMBL2036309
Molecular formulaC25H30N2O4S
IUPAC name4-[2-[(2R)-2-[(E,3S)-3-hydroxy-4-(3-pyridin-2-ylphenyl)but-1-enyl]-5-oxopyrrolidin-1-yl]ethylsulfanyl]butanoic acid
Molecular weight454.585
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP2.5
SynonymsSCHEMBL10210637
BDBM50385119
Inchi KeyKPLWANAFZOCKMN-JEUBMUGFSA-N
Inchi IDInChI=1S/C25H30N2O4S/c28-22(18-19-5-3-6-20(17-19)23-7-1-2-13-26-23)11-9-21-10-12-24(29)27(21)14-16-32-15-4-8-25(30)31/h1-3,5-7,9,11,13,17,21-22,28H,4,8,10,12,14-16,18H2,(H,30,31)/b11-9+/t21-,22+/m0/s1
PubChem CID57893916
ChEMBLCHEMBL2036309
IUPHARN/A
BindingDB50385119
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: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
174943Prostaglandin E2 receptor EP1 subtypeP35375Ptger1Mus musculus (Mouse)405
174944Prostaglandin E2 receptor EP2 subtypeQ62053Ptger2Mus musculus (Mouse)362
174945Prostaglandin E2 receptor EP3 subtypeP30557Ptger3Mus musculus (Mouse)365
174946Prostaglandin E2 receptor EP4 subtypeP32240Ptger4Mus musculus (Mouse)513
174947Prostaglandin E2 receptor EP4 subtypeP43114Ptger4Rattus norvegicus (Rat)488

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