pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
-4.9	AttenGpKa training set	2	1	CC(C)Cc1ccc2c(O)c3ccccc3[nH+]c2[nH+]1	CC(C)Cc1ccc2c(O)c3ccccc3[nH+]c2n1,CC(C)Cc1ccc2c(O)c3ccccc3nc2[nH+]1	mol26708	CC(C)Cc1ccc2c(O)c3ccccc3nc2n1