pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.52	Datawarrior	1	0	CC[NH+](CC)CCOC(=O)c1ccc2ccccc2c1	CCN(CC)CCOC(=O)c1ccc2ccccc2c1	mol14752	CCN(CC)CCOC(=O)c1ccc2ccccc2c1
7.51999998092651	QSARToolbox	1	0	CC[NH+](CC)CCOC(=O)c1ccc2ccccc2c1	CCN(CC)CCOC(=O)c1ccc2ccccc2c1	mol14752	CCN(CC)CCOC(=O)c1ccc2ccccc2c1