pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.3	Hunt	2	1	COc1cc[nH+]c(CSc2[nH]c3ccccc3[nH+]2)c1	COc1ccnc(CSc2[nH]c3ccccc3[nH+]2)c1,COc1cc[nH+]c(CSc2nc3ccccc3[nH]2)c1	mol615	COc1ccnc(CSc2nc3ccccc3[nH]2)c1