pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.14000034332275	QSARToolbox	0	-1	O=C(CC(=O)NO)NO	O=C([CH-]C(=O)NO)NO,O=C(CC(=O)NO)[N-]O,O=C(CC(=O)NO)N[O-]	mol31397	O=C(CC(=O)NO)NO
8.14	AttenGpKa training set	0	-1	O=C(CC(=O)NO)NO	O=C([CH-]C(=O)NO)NO,O=C(CC(=O)NO)[N-]O,O=C(CC(=O)NO)N[O-]	mol31397	O=C(CC(=O)NO)NO
9.63	AttenGpKa training set	-1	-2	O=C([CH-]C(=O)NO)NO,O=C(CC(=O)NO)[N-]O,O=C(CC(=O)NO)N[O-]	O=C([CH-]C(=O)NO)[N-]O,O=C([CH-]C(=O)NO)N[O-],O=C(CC(=O)[N-]O)[N-]O,O=C(CC(=O)N[O-])[N-]O,O=C(CC(=O)NO)[N-][O-]	mol31397	O=C(CC(=O)NO)NO