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Ligand

NameCHEMBL2036311
Molecular formulaC28H32N2O4S
IUPAC name4-[2-[(2R)-2-[(E,3S)-3-hydroxy-4-[3-(1H-indol-5-yl)phenyl]but-1-enyl]-5-oxopyrrolidin-1-yl]ethylsulfanyl]butanoic acid
Molecular weight492.634
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP3.7
SynonymsSCHEMBL10210685
BDBM50385121
Inchi KeyNUXMYQHRAUGVMF-RSURJUNSSA-N
Inchi IDInChI=1S/C28H32N2O4S/c31-25(9-7-24-8-11-27(32)30(24)14-16-35-15-2-5-28(33)34)18-20-3-1-4-21(17-20)22-6-10-26-23(19-22)12-13-29-26/h1,3-4,6-7,9-10,12-13,17,19,24-25,29,31H,2,5,8,11,14-16,18H2,(H,33,34)/b9-7+/t24-,25+/m0/s1
PubChem CID57893867
ChEMBLCHEMBL2036311
IUPHARN/A
BindingDB50385121
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
232759Prostaglandin E2 receptor EP1 subtypeP35375Ptger1Mus musculus (Mouse)405
232760Prostaglandin E2 receptor EP2 subtypeQ62053Ptger2Mus musculus (Mouse)362
232762Prostaglandin E2 receptor EP3 subtypeP30557Ptger3Mus musculus (Mouse)365
232761Prostaglandin E2 receptor EP4 subtypeP43114Ptger4Rattus norvegicus (Rat)488
232763Prostaglandin E2 receptor EP4 subtypeP32240Ptger4Mus musculus (Mouse)513

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