Novel chalcone derivatives of ursolic acid as acetylcholinesterase inhibitors: Synthesis, characterization, biological activity, ADME prediction, molecular docking and molecular dynamics studies
Halil Şenol, Mansour Ghaffari‐Moghaddam, Gülbahar Özge Alim Toraman, Uğur Güller
Topics & Concepts
ChemistryADMEUrsolic acidChalconeAcetylcholinesteraseStereochemistryMolecular dynamicsDocking (animal)IC50Acetylcholinesterase inhibitorMolecular mechanicsEnzymeComputational chemistryIn vitroBiochemistryChromatographyNursingMedicineComputational Drug Discovery MethodsCholinesterase and Neurodegenerative DiseasesSynthesis and biological activity