Topochemical models for anti-HIV activity of 1-alkoxy-5-alkyl-6-(arylthio)uracils |
| |
Authors: | S Bajaj A K Madan |
| |
Institution: | (1) SV College of Pharmacy, Ram Nagar (Banur), 140 601, India;(2) Faculty of Pharmaceutical Sciences, MD University, Rohtak, 124 001, India |
| |
Abstract: | Relationship between topochemical indices and anti-HIV-1 (HTLV-III) inhibitory activity of 1-alkoxy-5-alkyl-6-(arylthio)uracils
has been studied. Superadjacency, an adjacency-cum-distance-based, topochemical index and Wiener’s, a distance-based, topochemical
index were calculated for a set of 36 1-alkoxy-5-alkyl-6-(arylthio)uracils. Resulting data were analyzed and suitable models
were developed after identification of the active ranges. Subsequently, a biological activity was assigned to each of the
compounds using these models and compared with the reported anti-HIV-1 activity. High accuracy of prediction was observed
using these models. Statistical analysis revealed significance of the proposed models as well as a lack of correlation between
the topochemical indices employed for the chosen data set. |
| |
Keywords: | superadjacency topochemical index Wiener’ s topochemical index 1-alkoxy-5-alkyl-6-(arylthio)uracils topochemical models anti-HIV agents AIDS topological index |
本文献已被 SpringerLink 等数据库收录! |
|