DFT Computational Studies, Spectroscopic (UV–Vis, IR, NMR), In Silico Molecular Docking and ADME Study of 3-(3-Methylpyridin-2-yl)-5-phenyl-1,2,4-oxadiazole
Ravindra H. Waghchaure, Vishnu A. Adole
Topics & Concepts
ChemistryADMEComputational chemistryLipophilicityDensity functional theoryCarbon-13 NMRDocking (animal)Proton NMRChemical shiftQuantitative structure–activity relationshipStereochemistryPhysical chemistryMedicineBiochemistryIn vitroNursingSynthesis and biological activitySynthesis and Characterization of Heterocyclic CompoundsNonlinear Optical Materials Research