Synthesis, spectral analysis, DFT calculations, biological potential and molecular docking studies of indole appended pyrazolo-triazine
S. M. Basavarajaiah, G. Y. Nagesh, Mohammad Javeed, Rashmi Bhat, S. Nethravathi, N. Jeelan Basha, K. Ramakrishna Reddy, C. Nisarga, Pooja Srinivas
Topics & Concepts
Indole testChemistryHyperpolarizabilityDocking (animal)Density functional theoryHOMO/LUMONatural bond orbitalTriazineProtein Data Bank (RCSB PDB)StereochemistryCinnolineComputational chemistryQuantitative structure–activity relationshipAutoDockCombinatorial chemistryMoleculeOrganic chemistryPolarizabilityBiochemistryMedicineNursingGeneIn silicoSynthesis and Characterization of Heterocyclic CompoundsSynthesis and biological activitySynthesis and Biological Evaluation