pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.2	Datawarrior	0	-1	CC(=NO)c1cc(C)c(C)cc1O	CC(=NO)c1cc(C)c(C)cc1[O-]	mol13923	CC(=NO)c1cc(C)c(C)cc1O
8.1999998	OCHEM	0	-1	CC(=NO)c1cc(C)c(C)cc1O	CC(=NO)c1cc(C)c(C)cc1[O-]	mol13923	CC(=NO)c1cc(C)c(C)cc1O
8.19999980926514	QSARToolbox	0	-1	CC(=NO)c1cc(C)c(C)cc1O	CC(=NO)c1cc(C)c(C)cc1[O-]	mol13923	CC(=NO)c1cc(C)c(C)cc1O