Synthesis and Antifungal Properties of 1,2,4‐Triazole Schiff Base Agents Based on a 3D‐QSAR Model
Yun Hao,
Yunrui Feng,
Yangming Dong
et al.
Abstract:Based on our previous research, a 3D‐QSAR model (q2=0.51, ONC=5, r2=0.982, F=271.887, SEE=0.052) was established to predict the inhibitory effects of triazole Schiff base compounds on Fusarium graminearum, and its predictive ability was also confirmed through the statistical parameters. According to the results of the model design, 30 compounds with superior bioactivity compared to the template molecule 4 were obtained. Seven of these compounds (DES2‐6, DES9‐10) with improved biological activity and readily av… Show more
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