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Ligand

NameCHEMBL53774
Molecular formulaC19H25NO3
IUPAC name8-(4-acetyl-5-hydroxy-2-prop-2-enylphenoxy)octanenitrile
Molecular weight315.413
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.7
SynonymsSCHEMBL9417852
Inchi KeyBSOSPOXMOADWHG-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H25NO3/c1-3-10-16-13-17(15(2)21)18(22)14-19(16)23-12-9-7-5-4-6-8-11-20/h3,13-14,22H,1,4-10,12H2,2H3
PubChem CID14820079
ChEMBLCHEMBL53774
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
31882Leukotriene B4 receptor 1Q15722LTB4RHomo sapiens (Human)352

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