pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.24	Datawarrior	0	-1	N#C[C@@H](Cc1ccccc1)C(=O)O	N#C[C@@H](Cc1ccccc1)C(=O)[O-]	mol13922	N#CC(Cc1ccccc1)C(=O)O
2.24000000953674	QSARToolbox	0	-1	N#C[C@@H](Cc1ccccc1)C(=O)O	N#C[C@@H](Cc1ccccc1)C(=O)[O-]	mol13922	N#CC(Cc1ccccc1)C(=O)O