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Ligand

NameCHEMBL2036315
Molecular formulaC26H32N2O5S
IUPAC name4-[2-[(2R)-2-[(E,3S)-3-hydroxy-4-[3-(pyridin-3-ylmethoxy)phenyl]but-1-enyl]-5-oxopyrrolidin-1-yl]ethylsulfanyl]butanoic acid
Molecular weight484.611
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP2.3
SynonymsBDBM50385125
SCHEMBL10210629
Inchi KeyJSGJBDBGONKGOZ-UCQVOXAISA-N
Inchi IDInChI=1S/C26H32N2O5S/c29-23(16-20-4-1-6-24(17-20)33-19-21-5-2-12-27-18-21)10-8-22-9-11-25(30)28(22)13-15-34-14-3-7-26(31)32/h1-2,4-6,8,10,12,17-18,22-23,29H,3,7,9,11,13-16,19H2,(H,31,32)/b10-8+/t22-,23+/m0/s1
PubChem CID57894065
ChEMBLCHEMBL2036315
IUPHARN/A
BindingDB50385125
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
158727Prostaglandin E2 receptor EP1 subtypeP35375Ptger1Mus musculus (Mouse)405
158724Prostaglandin E2 receptor EP2 subtypeQ62053Ptger2Mus musculus (Mouse)362
158726Prostaglandin E2 receptor EP3 subtypeP30557Ptger3Mus musculus (Mouse)365
158725Prostaglandin E2 receptor EP4 subtypeP43114Ptger4Rattus norvegicus (Rat)488
158728Prostaglandin E2 receptor EP4 subtypeP32240Ptger4Mus musculus (Mouse)513

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