Chemical toxicity prediction bioinformatics tools

Compound toxicity detection software tools | Drug discovery data analysis

Determining the toxicity of chemicals is necessary to identify their harmful effects on humans, animals, plants, or the environment. It is also one of the main steps in drug design.

FAF-Drugs / Free ADMET Filtering

Allows users to detect small molecules. FAF-Drugs is a web application which allows users to filter large compound libraries or determine some ADME-Tox properties (Adsorption, Distribution, Metabolism, Excretion and Toxicity). The software first standardizes the molecular structures before computing the different parameters. It can assist in hit selection before chemical synthesis or ordering as well as in silico screening experiments.

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