Typically, these products, which are produced across several industries (e.g., consumer care, agrochemical, pharmaceutical; , are developed through trial-and-error by specialists with extensive experience in the given domain. Industry seeks a more systematic methodology to develop formulated products, particularly, as we wish to formulate novel products, either for enhanced performance and functionality , or for environmental reasons . We aim to train predictive surrogate models for liquid formulations design, so in simple terms, we needed to generate the most informative set of experimental data which represents our design space.