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Ligand

Name3-(3-(4-Octylphenyl)-2-oxoimidazolidin-1-yl)propanoic acid
Molecular formulaC20H30N2O3
IUPAC name3-[3-(4-octylphenyl)-2-oxoimidazolidin-1-yl]propanoic acid
Molecular weight346.471
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP4.6
SynonymsSCHEMBL177078
AIWHHHWZENRUGR-UHFFFAOYSA-N
US9707205, 13
BDBM255778
Inchi KeyAIWHHHWZENRUGR-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H30N2O3/c1-2-3-4-5-6-7-8-17-9-11-18(12-10-17)22-16-15-21(20(22)25)14-13-19(23)24/h9-12H,2-8,13-16H2,1H3,(H,23,24)
PubChem CID46199365
ChEMBLN/A
IUPHARN/A
BindingDB255778
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
557466Sphingosine 1-phosphate receptor 1P21453S1PR1Homo sapiens (Human)382

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