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Ligand

NameCHEMBL1929540
Molecular formulaC21H29NO4S2
IUPAC name4-[2-[(4S)-4-[(E,3S)-4-(3-ethylphenyl)-3-hydroxybut-1-enyl]-2-oxo-1,3-thiazolidin-3-yl]ethylsulfanyl]butanoic acid
Molecular weight423.586
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP3.4
SynonymsBDBM50360148
SCHEMBL4913635
Inchi KeyMYRBEESOULJTOW-WARJXXDVSA-N
Inchi IDInChI=1S/C21H29NO4S2/c1-2-16-5-3-6-17(13-16)14-19(23)9-8-18-15-28-21(26)22(18)10-12-27-11-4-7-20(24)25/h3,5-6,8-9,13,18-19,23H,2,4,7,10-12,14-15H2,1H3,(H,24,25)/b9-8+/t18-,19+/m0/s1
PubChem CID10093793
ChEMBLCHEMBL1929540
IUPHARN/A
BindingDB50360148
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
217370Prostaglandin E2 receptor EP1 subtypeP35375Ptger1Mus musculus (Mouse)405
217369Prostaglandin E2 receptor EP2 subtypeQ62053Ptger2Mus musculus (Mouse)362
217368Prostaglandin E2 receptor EP3 subtypeP30557Ptger3Mus musculus (Mouse)365
217366Prostaglandin E2 receptor EP4 subtypeP32240Ptger4Mus musculus (Mouse)513
217367Prostaglandin E2 receptor EP4 subtypeP43114Ptger4Rattus norvegicus (Rat)488

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