Work

2D/3D-QSAR-guided design of novel 1,2,4-triazole derivatives with predicted enhanced antimicrobial activity

Year: 2026

Type: article

Abstract: -bearing candidates (D1-D20) was designed on this basis; fine-grained ranking among them is presented as an exploratory tiebreaker only, since it rests on electronic descriptors that were not statistically significant. These predictions remain to be validated experimentally and are intended to guide future synthesis and biological testing.

Source: RSC Advances

DOI: 10.1039/d6ra03272a

Authors: Nataliya Korol, Oksana Mulesa, Olesia Symkanych, Mykhailo Slyvka

Institutions: Uzhhorod National University, University of Prešov

Language: English

Topic: Synthesis and Characterization of Heterocyclic Compounds

Subfield: Organic Chemistry

Field: Chemistry

Domain: Physical Sciences

Open Access status: gold

Estimated APC paid: $1,042

OpenAlex ID: W7225409105