QUANTITATIVE AND QUALITATIVE PREDICTIONS OF 4-AZIDO 2H-1,2,3- TRIAZOLES CYTOTOXICITY IN RELATION TO HUMAN BREAST CANCER CELL LINES

In the presented article, from this BC CLC-Pred web-application (Pass Online) has used for quantitative and qualitative predictions of substance cytotoxicity in relation to human nine breast cancer cell lines (T47D, ZR-75-1, MX1, Hs-578T, MCF7-DOX, MCF7, Bcap37, MCF7R, BT-20) for previously synthesized triazoles. Based on the obtained results, it was determined that the nature, strength, number and position of the functional groups in the aromatic ring in the molecule have a significant impact on the results. Thus, triazoles with electron donor groups showed higher activity than those with electroacceptor groups and at the same time, it was observed that the increase in the number of these groups had a positive effect on the activity. The position of functional groups in the aromatic ring, the presence or absence of conjugation in the compound and the effect of steric factors on biological activity are reflected in this article. Also, although the functional groups are of the same nature, depending on their strength (taking into account the mesomeric and electromeric effects), the number and types of active cells change, which in turn leads to interesting results.