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Ligand

NameCHEMBL1957434
Molecular formulaC22H24ClNO4S
IUPAC name5-[3-[(2R)-2-[(E,3S)-4-(3-chlorophenyl)-3-hydroxybut-1-enyl]-5-oxopyrrolidin-1-yl]propyl]thiophene-2-carboxylic acid
Molecular weight433.947
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP4.0
SynonymsBDBM50366142
SCHEMBL10210192
Inchi KeyFISCKHIBKSXUOC-JFDVKVQISA-N
Inchi IDInChI=1S/C22H24ClNO4S/c23-16-4-1-3-15(13-16)14-18(25)8-6-17-7-11-21(26)24(17)12-2-5-19-9-10-20(29-19)22(27)28/h1,3-4,6,8-10,13,17-18,25H,2,5,7,11-12,14H2,(H,27,28)/b8-6+/t17-,18+/m0/s1
PubChem CID57403612
ChEMBLCHEMBL1957434
IUPHARN/A
BindingDB50366142
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
79334Prostaglandin E2 receptor EP1 subtypeP35375Ptger1Mus musculus (Mouse)405
79336Prostaglandin E2 receptor EP2 subtypeQ62053Ptger2Mus musculus (Mouse)362
79337Prostaglandin E2 receptor EP3 subtypeP30557Ptger3Mus musculus (Mouse)365
79335Prostaglandin E2 receptor EP4 subtypeP32240Ptger4Mus musculus (Mouse)513

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