pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.17999982833862	QSARToolbox	1	0	CC(C)(O)c1cccc[nH+]1	CC(C)(O)c1ccccn1	mol35048	CC(C)(O)c1ccccn1