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Ligand

NameCHEMBL12114
Molecular formulaC20H34O5
IUPAC name(Z)-7-[(1R,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentyl]hept-5-enoic acid
Molecular weight354.487
Hydrogen bond acceptor5
Hydrogen bond donor4
XlogP2.7
SynonymsBDBM50020300
(S-isomer)7-[3,5-Dihydroxy-2-(3-hydroxy-oct-1-enyl)-cyclopentyl]-hept-5-enoic acid
SCHEMBL13416673
7-[3,5-Dihydroxy-2-(3-hydroxy-oct-1-enyl)-cyclopentyl]-hept-5-enoic acid
(Z)-7-[(1R,3R,5S)-3,5-Dihydroxy-2-((E)-(S)-3-hydroxy-oct-1-enyl)-cyclopentyl]-hept-5-enoic acid
[ Show all ]
Inchi KeyPXGPLTODNUVGFL-AFSIVQRVSA-N
Inchi IDInChI=1S/C20H34O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-19,21-23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t15-,16+,17?,18-,19+/m0/s1
PubChem CID12314605
ChEMBLN/A
IUPHARN/A
BindingDB50020300
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: 12
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
271227Prostacyclin receptorP43119PTGIRHomo sapiens (Human)386
271230Prostaglandin D2 receptorQ9R261PtgdrRattus norvegicus (Rat)357
271229Prostaglandin E2 receptor EP1 subtypeP35375Ptger1Mus musculus (Mouse)405
461561Prostaglandin E2 receptor EP1 subtypeP34995PTGER1Homo sapiens (Human)402
271224Prostaglandin E2 receptor EP2 subtypeP43116PTGER2Homo sapiens (Human)358
461562Prostaglandin E2 receptor EP3 subtypeP43115PTGER3Homo sapiens (Human)390
556533Prostaglandin E2 receptor EP3 subtypeP30557Ptger3Mus musculus (Mouse)365
461563Prostaglandin E2 receptor EP4 subtypeP35408PTGER4Homo sapiens (Human)488
271225Prostaglandin F2-alpha receptorP43088PTGFRHomo sapiens (Human)359
271226Prostaglandin F2-alpha receptorP37289PTGFRBos taurus (Bovine)362
271231Prostaglandin F2-alpha receptorP43117PtgfrMus musculus (Mouse)366
271228Thromboxane A2 receptorP30987Tbxa2rMus musculus (Mouse)341

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