pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
13.1	Datawarrior	0	-1	CCOC(=O)Cc1nc2ccccc2[nH]1	CCOC(=O)Cc1nc2ccccc2[n-]1	mol15721	CCOC(=O)Cc1nc2ccccc2[nH]1
5.7	Datawarrior	1	0	CCOC(=O)Cc1[nH]c2ccccc2[nH+]1	CCOC(=O)Cc1nc2ccccc2[nH]1	mol15721	CCOC(=O)Cc1nc2ccccc2[nH]1
5.6999998	OCHEM	1	0	CCOC(=O)Cc1[nH]c2ccccc2[nH+]1	CCOC(=O)Cc1nc2ccccc2[nH]1	mol15721	CCOC(=O)Cc1nc2ccccc2[nH]1
5.69999980926514	QSARToolbox	1	0	CCOC(=O)Cc1[nH]c2ccccc2[nH+]1	CCOC(=O)Cc1nc2ccccc2[nH]1	mol15721	CCOC(=O)Cc1nc2ccccc2[nH]1