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Ligand

NameCHEMBL62885
Molecular formulaC24H38O5
IUPAC name(Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(E,4S)-4-hydroxy-4-(1-propylcyclopentyl)but-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid
Molecular weight406.563
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP4.1
Synonyms(5Z)-7-[(1R)-2beta-[(1E,4S)-4-Hydroxy-4-(1-propylcyclopentyl)-1-butenyl]-3alpha-hydroxy-5-oxocyclopentane-1alpha-yl]-5-heptenoic acid
BDBM50101833
(Z)-7-{(1R,2R,3R)-3-Hydroxy-2-[(E)-(S)-4-hydroxy-4-(1-propyl-cyclopentyl)-but-1-enyl]-5-oxo-cyclopentyl}-hept-5-enoic acid
Inchi KeyCGVFVYJKFYSUMB-TWZLQVLMSA-N
Inchi IDInChI=1S/C24H38O5/c1-2-14-24(15-7-8-16-24)22(27)12-9-11-19-18(20(25)17-21(19)26)10-5-3-4-6-13-23(28)29/h3,5,9,11,18-19,21-22,26-27H,2,4,6-8,10,12-17H2,1H3,(H,28,29)/b5-3-,11-9+/t18-,19-,21-,22+/m1/s1
PubChem CID44303723
ChEMBLCHEMBL62885
IUPHARN/A
BindingDB50101833
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
41635Prostacyclin receptorP43119PTGIRHomo sapiens (Human)386
41634Prostaglandin E2 receptor EP1 subtypeP35375Ptger1Mus musculus (Mouse)405
41632Prostaglandin E2 receptor EP2 subtypeQ62053Ptger2Mus musculus (Mouse)362
41633Prostaglandin E2 receptor EP3 subtypeP30557Ptger3Mus musculus (Mouse)365
41636Prostaglandin E2 receptor EP4 subtypeP32240Ptger4Mus musculus (Mouse)513

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