pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.1	Datawarrior	0	-1	Nc1cc[nH+]cc1C(=O)[O-],[NH3+]c1ccncc1C(=O)[O-]	Nc1ccncc1C(=O)[O-]	mol12975	Nc1ccncc1C(=O)O
9.1000004	OCHEM	0	-1	Nc1cc[nH+]cc1C(=O)[O-],[NH3+]c1ccncc1C(=O)[O-]	Nc1ccncc1C(=O)[O-]	mol12975	Nc1ccncc1C(=O)O
9.10000038146973	QSARToolbox	0	-1	Nc1cc[nH+]cc1C(=O)[O-],[NH3+]c1ccncc1C(=O)[O-]	Nc1ccncc1C(=O)[O-]	mol12975	Nc1ccncc1C(=O)O
