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Ligand

NameCHEMBL293242
Molecular formulaC23H36O5
IUPAC name(E)-7-[(1R,3R)-3-hydroxy-2-[(E,4S)-4-hydroxy-4-(1-propylcyclobutyl)but-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid
Molecular weight392.536
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP3.6
SynonymsBDBM50101832
(E)-7-{(1R,3R)-3-Hydroxy-2-[(E)-(S)-4-hydroxy-4-(1-propyl-cyclobutyl)-but-1-enyl]-5-oxo-cyclopentyl}-hept-5-enoic acid
Inchi KeyHJVBXPOYFHMZAS-DXLHXWNHSA-N
Inchi IDInChI=1S/C23H36O5/c1-2-13-23(14-8-15-23)21(26)11-7-10-18-17(19(24)16-20(18)25)9-5-3-4-6-12-22(27)28/h3,5,7,10,17-18,20-21,25-26H,2,4,6,8-9,11-16H2,1H3,(H,27,28)/b5-3+,10-7+/t17-,18?,20-,21+/m1/s1
PubChem CID44304199
ChEMBLCHEMBL293242
IUPHARN/A
BindingDB50101832
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
116848Prostacyclin receptorP43119PTGIRHomo sapiens (Human)386
116850Prostaglandin E2 receptor EP1 subtypeP35375Ptger1Mus musculus (Mouse)405
116851Prostaglandin E2 receptor EP2 subtypeQ62053Ptger2Mus musculus (Mouse)362
116847Prostaglandin E2 receptor EP3 subtypeP30557Ptger3Mus musculus (Mouse)365
116849Prostaglandin E2 receptor EP4 subtypeP32240Ptger4Mus musculus (Mouse)513

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