This table contains the dissociation constants, maximum changes in absorbance, and ratio of dissociation constant to maximum change in absorbance as calculated for compounds from the a library of 104 azoles. Compounds that did not result in a spectral shift are denoted with dashes. Properties of each azole is also included such as CAS, ClogP, number of rotatable bonds, TPSA (Å2), IUPAC name, and SMILES structure.