预测抗咳药物的新精神活性物质活性,并评估它们对鱼类的生态毒性

Wen-Jun Shi1, Xiao-Bing Long1, Lei Xin1

  • 1SCNU Environmental Research Institute, Guangdong Provincial Key Laboratory of Chemical Pollution and Environmental Safety & MOE Key Laboratory of Theoretical Chemistry of Environment, South China Normal University, Guangzhou 510006, China; School of Environment, South China Normal University, University Town, Guangzhou 510006, China.

概括

抗咳药可能具有新的精神活性物质 (NPS) 活性,并对鱼类构成生态风险. 机器学习模型确定了15种抗咳药物,具有潜在的NPS活性和对水生生物的显著毒性.