pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.94999980926514	QSARToolbox	0	-1	N#CC(C#N)[C@H](c1ccc([N+](=O)[O-])cc1)N1CCCCC1	N#C[C-](C#N)[C@H](c1ccc([N+](=O)[O-])cc1)N1CCCCC1	mol37088	N#CC(C#N)C(c1ccc([N+](=O)[O-])cc1)N1CCCCC1