We calculated the descriptors of the active molecules with alvaDesc (Alvascience, alvaDesc (software for molecular descriptors calculation) version 2.0.10, 2021, ). This program has the same algorithms for the computation of descriptors as alvaBuilder. With this information, we set up the donor atoms for H-bonds to be ≥ 2 and the SAscore to ≤ 5.979. For the rest of the descriptors, the range was designated to the mean ± the standard deviation of the calculated numerical values for the active inhibitors.