pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.0	IUPAC digitized pKa	-2	-3	[O-]N=C1CCCC(=NO)C1=N[O-],[O-]N=C1CCCC(=N[O-])C1=NO	[O-]N=C1CCCC(=N[O-])C1=N[O-]	mol9772	ON=C1CCCC(=NO)C1=NO
8.1199999	OCHEM	-2	-3	[O-]N=C1CCCC(=NO)C1=N[O-],[O-]N=C1CCCC(=N[O-])C1=NO	[O-]N=C1CCCC(=N[O-])C1=N[O-]	mol9772	ON=C1CCCC(=NO)C1=NO
11.09	Datawarrior	-1	-2	[O-]N=C1CCCC(=NO)C1=NO,[O-]N=C1C(=NO)CCCC1=NO	[O-]N=C1CCCC(=NO)C1=N[O-],[O-]N=C1CCCC(=N[O-])C1=NO	mol9772	ON=C1CCCC(=NO)C1=NO