pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.6	Datawarrior	1	0	CC(=O)Nc1ccc2cc3ccccc3[nH+]c2c1	CC(=O)Nc1ccc2cc3ccccc3nc2c1	mol14827	CC(=O)Nc1ccc2cc3ccccc3nc2c1
5.5999999	OCHEM	1	0	CC(=O)Nc1ccc2cc3ccccc3[nH+]c2c1	CC(=O)Nc1ccc2cc3ccccc3nc2c1	mol14827	CC(=O)Nc1ccc2cc3ccccc3nc2c1
5.59999990463257	QSARToolbox	1	0	CC(=O)Nc1ccc2cc3ccccc3[nH+]c2c1	CC(=O)Nc1ccc2cc3ccccc3nc2c1	mol14827	CC(=O)Nc1ccc2cc3ccccc3nc2c1