BigSolDB 2.0, dataset of solubility values for organic compounds in different solvents at various temperatures

Lev Krasnov, Dmitry Malikov, Marina Kiseleva, Sergei V. Tatarin, Sergey Sosnin, Stanislav Bezzubov

Published: 15 Mar 2026, Last Modified: 16 Jun 2026AI4X-AC 2026 PosterEveryoneRevisionsBibTeXCC BY 4.0
Submission Type: I want my submission to be considered for poster only
Keywords: Solubility, Cheminformatics, Machine Learning
TL;DR: BigSolDB 2.0 is a large-scale experimental solubility dataset across diverse solvents, designed for training, validating, and benchmarking AI models in chemistry.
Confirmation Of Submission Requirements: I submit a previously published paper. It was published in an archival peer–reviewed venue on or after September 1st 2025, I specify the DOI in the field below, and I submit the camera-ready version of the paper.
DOI: https://doi.org/10.1038/s41597-025-05559-8
Submission Number: 153