pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.54	OCHEM	1	0	C[S+](C)CC(=O)/C=N/O	C[S+](C)CC(=O)/C=N/[O-]	mol20943	C[S+](C)CC(=O)/C=N/O
6.78000020980835	QSARToolbox	1	0	C[S+](C)CC(=O)/C=N/O	C[S+](C)CC(=O)/C=N/[O-]	mol20943	C[S+](C)CC(=O)/C=N/O
6.53999996185303	QSARToolbox	1	0	C[S+](C)CC(=O)/C=N/O	C[S+](C)CC(=O)/C=N/[O-]	mol20943	C[S+](C)CC(=O)/C=N/O
10.5500001907349	QSARToolbox	1	0	C[S+](C)CC(=O)/C=N/O	C[S+](C)CC(=O)/C=N/[O-]	mol20943	C[S+](C)CC(=O)/C=N/O