The databank of chemical structures was populated by drawing the two-dimensional structures of the Generally Recognised as Safe obtained by the list of the regulatory agency, Food and Drug Administration (FDA, http://www.fda.gov), n = 364 and from the Flavour and Extract Manufacturers Association (FEMA, https://www.femaflavor.org/), n = 2,500 in 2019. This databank was used to write the article "Evaluation of general toxicity in food constituents using in silico tools. Rev. Virtual Quim., 2019, 11 (2), 543-553.