Molecular parameters and the antimicrobial activity of functional derivatives of n-,r-amines

M. Yu. Golik, O. S. Kryskiv, K. I. Dudka, O. V. Kolisnyk

Abstract


To check for conformity of the “drug-likeness” concept in the series of functional derivatives of N-R-amines their physico-chemical parameters have been calculated using the ChemBio3D Ultra 14.0 software; they determine bioavailability according to Lipinski rules. The abovementioned derivatives are shown to be promising for further study. Using the correlation and regression analysis the quantitative “structure – antimicrobial activity” relationship has been determined among some N-R-amines, and it can be useful while searching biologically active substances in the given series.


Keywords


molecular descriptors; “drug-likeness” concept; Lipinski rules; antimicrobial activity

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References


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DOI: https://doi.org/10.24959/88797

Abbreviated key title: Vìsn. farm.

ISSN 2415-8844 (Online), ISSN 1562-7241 (Print)