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Ligand

NameCHEMBL2036307
Molecular formulaC26H31NO4S
IUPAC name4-[2-[(2R)-2-[(E,3S)-3-hydroxy-4-(3-phenylphenyl)but-1-enyl]-5-oxopyrrolidin-1-yl]ethylsulfanyl]butanoic acid
Molecular weight453.597
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP3.6
SynonymsSCHEMBL14270381
BDBM50385140
Inchi KeyKKFNXXORVOYZEM-KVKMCETFSA-N
Inchi IDInChI=1S/C26H31NO4S/c28-24(19-20-6-4-9-22(18-20)21-7-2-1-3-8-21)13-11-23-12-14-25(29)27(23)15-17-32-16-5-10-26(30)31/h1-4,6-9,11,13,18,23-24,28H,5,10,12,14-17,19H2,(H,30,31)/b13-11+/t23-,24+/m0/s1
PubChem CID10026946
ChEMBLCHEMBL2036307
IUPHARN/A
BindingDB50385140
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
171109Prostaglandin E2 receptor EP1 subtypeP35375Ptger1Mus musculus (Mouse)405
171108Prostaglandin E2 receptor EP2 subtypeQ62053Ptger2Mus musculus (Mouse)362
171111Prostaglandin E2 receptor EP3 subtypeP30557Ptger3Mus musculus (Mouse)365
171107Prostaglandin E2 receptor EP4 subtypeP43114Ptger4Rattus norvegicus (Rat)488
171110Prostaglandin E2 receptor EP4 subtypeP32240Ptger4Mus musculus (Mouse)513

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