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Ligand

NameCHEMBL52630
Molecular formulaC18H25NO3
IUPAC name5-(4-acetyl-5-hydroxy-2-pentylphenoxy)pentanenitrile
Molecular weight303.402
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.6
SynonymsSCHEMBL9417790
Inchi KeyDXLPKDYAGSXCRM-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H25NO3/c1-3-4-6-9-15-12-16(14(2)20)17(21)13-18(15)22-11-8-5-7-10-19/h12-13,21H,3-9,11H2,1-2H3
PubChem CID14820065
ChEMBLCHEMBL52630
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
71391Leukotriene B4 receptor 1Q15722LTB4RHomo sapiens (Human)352

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