pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.47	Datawarrior	1	0	CSc1ccc([NH3+])cc1[N+](=O)[O-]	CSc1ccc(N)cc1[N+](=O)[O-]	mol1710	CSc1ccc(N)cc1[N+](=O)[O-]
2.47000002861023	QSARToolbox	1	0	CSc1ccc([NH3+])cc1[N+](=O)[O-]	CSc1ccc(N)cc1[N+](=O)[O-]	mol1710	CSc1ccc(N)cc1[N+](=O)[O-]