pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.3	Datawarrior	0	-1	CC(=O)C(C)=NO	CC(=O)C(C)=N[O-]	mol15975	CC(=O)C(C)=NO
9.3000002	OCHEM	0	-1	CC(=O)C(C)=NO	CC(=O)C(C)=N[O-]	mol15975	CC(=O)C(C)=NO
9.30000019073486	QSARToolbox	0	-1	CC(=O)C(C)=NO	CC(=O)C(C)=N[O-]	mol15975	CC(=O)C(C)=NO
9.97000026702881	QSARToolbox	0	-1	CC(=O)C(C)=NO	CC(=O)C(C)=N[O-]	mol15975	CC(=O)C(C)=NO
10.6199998855591	QSARToolbox	0	-1	CC(=O)C(C)=NO	CC(=O)C(C)=N[O-]	mol15975	CC(=O)C(C)=NO
12.0699996948242	QSARToolbox	0	-1	CC(=O)C(C)=NO	CC(=O)C(C)=N[O-]	mol15975	CC(=O)C(C)=NO