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Ligand

NameCHEMBL60555
Molecular formulaC19H32O5S
IUPAC name5-[[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]methylsulfanyl]pentanoic acid
Molecular weight372.52
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP2.2
Synonyms(11R,13E,15S)-9-Oxo-11,15-dihydroxy-6-thiaprosta-13-ene-1-oic acid
BDBM50101862
5-[(S)-(R)-3-Hydroxy-2-((1R,2R)-3-hydroxy-oct-1-enyl)-5-oxo-cyclopentylmethylsulfanyl]-pentanoic acid
Inchi KeyCWUOLAUUOCLFCW-ZVBMZXMJSA-N
Inchi IDInChI=1S/C19H32O5S/c1-2-3-4-7-14(20)9-10-15-16(18(22)12-17(15)21)13-25-11-6-5-8-19(23)24/h9-10,14-17,20-21H,2-8,11-13H2,1H3,(H,23,24)/b10-9+/t14-,15+,16+,17+/m0/s1
PubChem CID44304334
ChEMBLCHEMBL60555
IUPHARN/A
BindingDB50101862
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
52448Prostacyclin receptorP43119PTGIRHomo sapiens (Human)386
52447Prostaglandin E2 receptor EP1 subtypeP35375Ptger1Mus musculus (Mouse)405
52449Prostaglandin E2 receptor EP2 subtypeQ62053Ptger2Mus musculus (Mouse)362
52446Prostaglandin E2 receptor EP3 subtypeP30557Ptger3Mus musculus (Mouse)365
52450Prostaglandin E2 receptor EP4 subtypeP32240Ptger4Mus musculus (Mouse)513

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