pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.62	Datawarrior	0	-1	CCOC(=O)c1cnc2ccccc2c1O	CCOC(=O)c1cnc2ccccc2c1[O-]	mol14588	CCOC(=O)c1cnc2ccccc2c1O
9.6199999	OCHEM	0	-1	CCOC(=O)c1cnc2ccccc2c1O	CCOC(=O)c1cnc2ccccc2c1[O-]	mol14588	CCOC(=O)c1cnc2ccccc2c1O
9.75	QSARToolbox	0	-1	CCOC(=O)c1cnc2ccccc2c1O	CCOC(=O)c1cnc2ccccc2c1[O-]	mol14588	CCOC(=O)c1cnc2ccccc2c1O
8.80000019073486	QSARToolbox	0	-1	CCOC(=O)c1cnc2ccccc2c1O	CCOC(=O)c1cnc2ccccc2c1[O-]	mol14588	CCOC(=O)c1cnc2ccccc2c1O