pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.30980014801025	QSARToolbox	0	-1	O=C(O)Cc1ccc(N(CCCl)CCCl)cc1,O=C([O-])Cc1ccc([NH+](CCCl)CCCl)cc1	O=C([O-])Cc1ccc(N(CCCl)CCCl)cc1	mol33958	O=C(O)Cc1ccc(N(CCCl)CCCl)cc1
2.01999998092651	QSARToolbox	0	-1	O=C(O)Cc1ccc(N(CCCl)CCCl)cc1,O=C([O-])Cc1ccc([NH+](CCCl)CCCl)cc1	O=C([O-])Cc1ccc(N(CCCl)CCCl)cc1	mol33958	O=C(O)Cc1ccc(N(CCCl)CCCl)cc1