Author

N. Hristova-Avakumova

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Open access Jul 2026

Effects of Chlorine and Methyl Substitution on Structure, IR, and Raman Spectra of the Biomolecule 6-Chloro-3-methyluracil in Isolated and Solid States and in Base-Pair Formation

The effect of the chlorine atom in the sixth position and methyl group in the third position of the uracil ring on the structural parameters, NBO charge distribution, and molecular properties of the 6-chloro-3-methyluracil (M6CU) biomolecule was analyzed in the isolated state, solid-state arrangement and within a doubl...

M. Palafox, N. Belskaya, N. Hristova-Avakumova et al. · Molecules · 0 citations

Open access Aug 2026

Molecular Striptease of a Thiadiazolopyrimidine Hit Yields a Streamlined, Artifact-Free NADPH Mimic for NOX Inhibition

Compound 5, although aqueous solubility issues limited its cellular antiproliferative performance, represents a specific, artifact-free architectural starting point for future selective NOX inhibitor development.

Emanuele Fabbrizi, Andrea Mancini, Chiara Lambona et al. · ACS Medicinal Chemistry Lett... · 0 citations