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Ligand

Name5-(4-acetyl-5-hydroxy-2-allylphenoxy)pentanenitrile
Molecular formulaC16H19NO3
IUPAC name5-(4-acetyl-5-hydroxy-2-prop-2-enylphenoxy)pentanenitrile
Molecular weight273.332
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.2
SynonymsSCHEMBL9417877
CHEMBL51902
5-[4-acetyl-5-hydroxy-2-allylphenoxy]pentanenitrile
DZNVZWBBGRCHFP-UHFFFAOYSA-N
Inchi KeyDZNVZWBBGRCHFP-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H19NO3/c1-3-7-13-10-14(12(2)18)15(19)11-16(13)20-9-6-4-5-8-17/h3,10-11,19H,1,4-7,9H2,2H3
PubChem CID14820095
ChEMBLCHEMBL51902
IUPHARN/A
BindingDBN/A
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
72848Leukotriene B4 receptor 1Q15722LTB4RHomo sapiens (Human)352

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