Srinivasni H, Shivani V, Seenivasan L, Francis M saleshier

Structure-guided multiscale evaluation of 5-nitroisatin mannich bases targeting pantothenate synthetase: DFT, ADMET, molecular docking, molecular dynamics and In Vitro antitubercular screening

AbstractAn integrated drug-discovery strategy was employed to design, synthesize, and evaluate aseries of isatinmannich bases as potential antitubercular agents, combining computationalapproaches with experimental biological screening. Structurally diverse isatinmannichderivative...