pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.81	Datawarrior	0	-1	CCOC(=O)[C@H](Cc1ccccc1)C(C)=O	CCOC(=O)[C-](Cc1ccccc1)C(C)=O	mol14427	CCOC(=O)C(Cc1ccccc1)C(C)=O
11.8000001907349	QSARToolbox	0	-1	CCOC(=O)[C@H](Cc1ccccc1)C(C)=O	CCOC(=O)[C-](Cc1ccccc1)C(C)=O	mol14427	CCOC(=O)C(Cc1ccccc1)C(C)=O
11.8100004196167	QSARToolbox	0	-1	CCOC(=O)[C@H](Cc1ccccc1)C(C)=O	CCOC(=O)[C-](Cc1ccccc1)C(C)=O	mol14427	CCOC(=O)C(Cc1ccccc1)C(C)=O