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Ligand

NameCHEMBL2037289
Molecular formulaC28H27N3O5S2
IUPAC name2-[2-[(2R)-2-[(E,3S)-3-hydroxy-4-[3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]but-1-enyl]-5-oxopyrrolidin-1-yl]ethylsulfanyl]-1,3-thiazole-4-carboxylic acid
Molecular weight549.66
Hydrogen bond acceptor9
Hydrogen bond donor2
XlogP4.7
SynonymsBDBM50385136
SCHEMBL14270362
Inchi KeyJUFYXGLEONTECM-KSFASEQNSA-N
Inchi IDInChI=1S/C28H27N3O5S2/c1-17-5-9-22-24(13-17)36-26(29-22)19-4-2-3-18(14-19)15-21(32)8-6-20-7-10-25(33)31(20)11-12-37-28-30-23(16-38-28)27(34)35/h2-6,8-9,13-14,16,20-21,32H,7,10-12,15H2,1H3,(H,34,35)/b8-6+/t20-,21+/m0/s1
PubChem CID58932683
ChEMBLCHEMBL2037289
IUPHARN/A
BindingDB50385136
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
160113Prostaglandin E2 receptor EP1 subtypeP35375Ptger1Mus musculus (Mouse)405
160115Prostaglandin E2 receptor EP2 subtypeQ62053Ptger2Mus musculus (Mouse)362
160118Prostaglandin E2 receptor EP2 subtypeQ62928Ptger2Rattus norvegicus (Rat)357
160117Prostaglandin E2 receptor EP3 subtypeP30557Ptger3Mus musculus (Mouse)365
160114Prostaglandin E2 receptor EP4 subtypeP43114Ptger4Rattus norvegicus (Rat)488
160116Prostaglandin E2 receptor EP4 subtypeP32240Ptger4Mus musculus (Mouse)513

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