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Ligand

NameCHEMBL1929541
Molecular formulaC22H31NO4S2
IUPAC name4-[2-[(4S)-4-[(E,3S)-3-hydroxy-4-(3-propylphenyl)but-1-enyl]-2-oxo-1,3-thiazolidin-3-yl]ethylsulfanyl]butanoic acid
Molecular weight437.613
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP3.9
SynonymsSCHEMBL4912005
BDBM50360149
Inchi KeyQRVTYTUOOOVOOR-ILXKITPQSA-N
Inchi IDInChI=1S/C22H31NO4S2/c1-2-5-17-6-3-7-18(14-17)15-20(24)10-9-19-16-29-22(27)23(19)11-13-28-12-4-8-21(25)26/h3,6-7,9-10,14,19-20,24H,2,4-5,8,11-13,15-16H2,1H3,(H,25,26)/b10-9+/t19-,20+/m0/s1
PubChem CID10048720
ChEMBLCHEMBL1929541
IUPHARN/A
BindingDB50360149
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
285387Prostaglandin E2 receptor EP1 subtypeP35375Ptger1Mus musculus (Mouse)405
285386Prostaglandin E2 receptor EP2 subtypeQ62053Ptger2Mus musculus (Mouse)362
285390Prostaglandin E2 receptor EP3 subtypeP30557Ptger3Mus musculus (Mouse)365
285388Prostaglandin E2 receptor EP4 subtypeP32240Ptger4Mus musculus (Mouse)513
285389Prostaglandin E2 receptor EP4 subtypeP43114Ptger4Rattus norvegicus (Rat)488

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