pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.30000019073486	QSARToolbox	2	1	CC(C)OC(=O)c1ccc[n+](CCC[n+]2cccc(C=NO)c2)c1	CC(C)OC(=O)c1ccc[n+](CCC[n+]2cccc(C=N[O-])c2)c1	mol37849	CC(C)OC(=O)c1ccc[n+](CCC[n+]2cccc(C=NO)c2)c1