Replication Data for: A concise SAR-analysis of antimicrobial cationic amphipathic barbiturates for an improved activity-toxicity profile

This dataset contains the analytical data of 58 amphipathic, tetrasubstituted barbituric acid derivatives and their synthetic intermediates. The analytical data includes NMR raw data and HRMS, IR and SFC data as PDF files. The barbituric acid derivatives were constructed to be mimics of antimicrobial peptides (AMPs) and were tested for their antimicrobial activity in the study \"A concise SAR-analysis of antimicrobial cationic amphipathic barbiturates for an improved activity-toxicity profile\". The structure of all compounds can be found in the data files.

本数据集包含58种两亲性四取代巴比妥酸衍生物及其合成中间体的分析数据。该分析数据以PDF文件形式涵盖核磁共振（Nuclear Magnetic Resonance, NMR）原始数据、高分辨质谱（High Resolution Mass Spectrometry, HRMS）、红外光谱（Infrared Spectroscopy, IR）及超临界流体色谱（Supercritical Fluid Chromatography, SFC）数据。上述巴比妥酸衍生物被设计为抗菌肽（Antimicrobial Peptides, AMPs）的模拟物，并在题为《用于优化活性-毒性谱的阳离子两亲性巴比妥酸类化合物简洁构效关系分析》（A concise SAR-analysis of antimicrobial cationic amphipathic barbiturates for an improved activity-toxicity profile）的研究中完成了抗菌活性测试。所有化合物的结构均可在数据文件中查阅。