pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.01	OCHEM	0	-1	[NH3+][C@H](Cc1ccccc1F)C(=O)[O-]	N[C@H](Cc1ccccc1F)C(=O)[O-]	mol33064	NC(Cc1ccccc1F)C(=O)O
9.10000038146973	QSARToolbox	0	-1	[NH3+][C@H](Cc1ccccc1F)C(=O)[O-]	N[C@H](Cc1ccccc1F)C(=O)[O-]	mol33064	NC(Cc1ccccc1F)C(=O)O
2.12	OCHEM	1	0	[NH3+][C@H](Cc1ccccc1F)C(=O)O	[NH3+][C@H](Cc1ccccc1F)C(=O)[O-]	mol33064	NC(Cc1ccccc1F)C(=O)O
2.11999988555908	QSARToolbox	1	0	[NH3+][C@H](Cc1ccccc1F)C(=O)O	[NH3+][C@H](Cc1ccccc1F)C(=O)[O-]	mol33064	NC(Cc1ccccc1F)C(=O)O