This work describes the growth of a proton-transfer single crystal, 2-aminopyridinium dihydrogen phosphate (2APDHP), using the slow solvent evaporation technique and confirmed that the crystal belongs to the monoclinic system.
G. Sivaraj, N. Jayamani, T. M. Viswanathan et al.· Asian Journal of Chemistry· 0 citations
The results indicate that structural modification of sulfadiazine through heterocyclic ring formation significantly enhances antibacterial activity and binding affinity, suggesting their potential as promising antimicrobial agents.
Rusul Zamil Abdulhassan, N. Majeed· Applied Chemistry for Engine...· 0 citations
This study combines structure-based molecular docking simulations and DFT calculations to investigate interactions between the crystal structure of human Spermine Oxidase (SMOX) and a series of three novel 2,4,6-substituted pyridine compounds as docking-prioritized SMOX-interacting candidates. The synthesis employed ta...
Omar Salih, Ahmed M. Sadoon· Journal of the Turkish Chemi...· 0 citations
Overall, these findings identify coumarin-hydrazide-hydrazone derivatives as computationally prioritized scaffolds that require biochemical CA inhibition and cellular validation before any anticancer conclusion can be drawn.
Ayuub J. Mohammed, Noor H. Naser, Wathiq Al-hachami· Pharmacia· 0 citations
Favourable binding energies and significant intermolecular interactions highlight these thiazine derivatives as promising leads for further antibacterial development.
Suhas Y. Salunkhe, S. D. Patil, P. J. Menezes et al.· Main group chemistry (Print)· 0 citations
Promising compounds like SBB-2, SBB-3, SBB-5, SBB-6, and SBB-7 exhibit favourable physicochemical properties, high drug-likeness, solubility, and a non-toxic profile, making them strong candidates for further development of a promising drug.
D. Upadhyay, Drashti Thanki, C. Somaiya· Current Organic Synthesis· 0 citations
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