pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.2	Datawarrior	1	0	CC[NH+](CC)Cc1ccccc1OC	CCN(CC)Cc1ccccc1OC	mol13285	CCN(CC)Cc1ccccc1OC
10.1999998092651	QSARToolbox	1	0	CC[NH+](CC)Cc1ccccc1OC	CCN(CC)Cc1ccccc1OC	mol13285	CCN(CC)Cc1ccccc1OC