pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.9	Datawarrior	1	0	c1ccc(CC2=[NH+]CCC2)cc1	c1ccc(CC2=NCCC2)cc1	mol12793	c1ccc(CC2=NCCC2)cc1
6.9000001	OCHEM	1	0	c1ccc(CC2=[NH+]CCC2)cc1	c1ccc(CC2=NCCC2)cc1	mol12793	c1ccc(CC2=NCCC2)cc1
6.90000009536743	QSARToolbox	1	0	c1ccc(CC2=[NH+]CCC2)cc1	c1ccc(CC2=NCCC2)cc1	mol12793	c1ccc(CC2=NCCC2)cc1