What are the thermodynamic properties that control how organic compounds behave?
The volatility of the compound expressed as a vapour pressure or Henry’s law constant, its solubility in water with respect to the solid compound or hydrate, dissociation constants (if the compound is an acid), and how its activity coefficients in the liquid phase(s) are calculated. Users can specify whether the compound will partition between any aqueous and hydrophobic phases that may exist, or restrict them to a single phase.