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Ligand

NameCHEMBL1929544
Molecular formulaC21H29NO5S2
IUPAC name4-[2-[(4S)-4-[(E,3S)-3-hydroxy-4-[3-(methoxymethyl)phenyl]but-1-enyl]-2-oxo-1,3-thiazolidin-3-yl]ethylsulfanyl]butanoic acid
Molecular weight439.585
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP2.2
SynonymsBDBM50360173
SCHEMBL4902743
Inchi KeyMVEMMBOSLWSLRW-YZPMEYCISA-N
Inchi IDInChI=1S/C21H29NO5S2/c1-27-14-17-5-2-4-16(12-17)13-19(23)8-7-18-15-29-21(26)22(18)9-11-28-10-3-6-20(24)25/h2,4-5,7-8,12,18-19,23H,3,6,9-11,13-15H2,1H3,(H,24,25)/b8-7+/t18-,19+/m0/s1
PubChem CID11743927
ChEMBLCHEMBL1929544
IUPHARN/A
BindingDB50360173
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
214942Prostaglandin E2 receptor EP1 subtypeP35375Ptger1Mus musculus (Mouse)405
214945Prostaglandin E2 receptor EP2 subtypeQ62053Ptger2Mus musculus (Mouse)362
214944Prostaglandin E2 receptor EP3 subtypeP30557Ptger3Mus musculus (Mouse)365
214943Prostaglandin E2 receptor EP4 subtypeP32240Ptger4Mus musculus (Mouse)513
214946Prostaglandin E2 receptor EP4 subtypeP43114Ptger4Rattus norvegicus (Rat)488

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