pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.47	IUPAC digitized pKa	0	-1	CC(=N[O-])C(C[NH+]1CCCCC1)=NO,CC(=NO)C(C[NH+]1CCCCC1)=N[O-],CC(=NO)C(CN1CCCCC1)=NO	CC(=N[O-])C(CN1CCCCC1)=NO,CC(=N[O-])C(C[NH+]1CCCCC1)=N[O-],CC(=NO)C(CN1CCCCC1)=N[O-]	mol11101	CC(=NO)C(CN1CCCCC1)=NO
10.6	IUPAC digitized pKa	-1	-2	CC(=N[O-])C(CN1CCCCC1)=NO,CC(=N[O-])C(C[NH+]1CCCCC1)=N[O-],CC(=NO)C(CN1CCCCC1)=N[O-]	CC(=N[O-])C(CN1CCCCC1)=N[O-]	mol11101	CC(=NO)C(CN1CCCCC1)=NO