pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.3000002	OCHEM	1	0	CN(C)c1ccc(C=Cc2cc[n+](O)cc2)cc1,C[NH+](C)c1ccc(C=Cc2cc[n+]([O-])cc2)cc1	CN(C)c1ccc(C=Cc2cc[n+]([O-])cc2)cc1	mol32633	CN(C)c1ccc(C=Cc2cc[n+]([O-])cc2)cc1
4.30000019073486	QSARToolbox	1	0	CN(C)c1ccc(C=Cc2cc[n+](O)cc2)cc1,C[NH+](C)c1ccc(C=Cc2cc[n+]([O-])cc2)cc1	CN(C)c1ccc(C=Cc2cc[n+]([O-])cc2)cc1	mol32633	CN(C)c1ccc(C=Cc2cc[n+]([O-])cc2)cc1