Some pyrimidohexahydroquinoline candidates: synthesis, DFT, cytotoxic activity evaluation, molecular docking, and <i>in silico</i> studies
Sayed K. Ramadan, Hisham S. M. Abd‐Rabboh, Amal A. Abdel Hafez, Wael S. I. Abou‐Elmagd
Abstract
Hexahydroquinolines were prepared and supported by in silico studies. Thiosemicarbazide and thiazolidinone derivatives showed the highest in vitro antiproliferative potency against liver, breast, prostate, and colon cancer cell lines.
Topics & Concepts
In silicoPotencyChemistryIn vitroDocking (animal)Cytotoxic T cellStereochemistryProstate cancerPharmacologyCancer cell linesComputational biologyCombinatorial chemistryBiochemistryCancer cellBiologyCancerMedicineGeneticsNursingGeneSynthesis and biological activitySynthesis and Characterization of Heterocyclic CompoundsSynthesis of heterocyclic compounds