pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.86	AttenGpKa training set	2	1	CN(C)c1ccc(/C=C/c2cccc(/C=C/c3ccc([NH+](C)C)cc3)[n+]2C)cc1	CN(C)c1ccc(/C=C/c2cccc(/C=C/c3ccc(N(C)C)cc3)[n+]2C)cc1	mol24232	CN(C)c1ccc(/C=C/c2cccc(/C=C/c3ccc(N(C)C)cc3)[n+]2C)cc1