pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.71	Datawarrior	1	0	c1ccc(-c2ccc3[nH+]ccn3n2)cc1,c1ccc(-c2ccc3nccn3[nH+]2)cc1	c1ccc(-c2ccc3nccn3n2)cc1	mol15819	c1ccc(-c2ccc3nccn3n2)cc1
4.71000003814697	QSARToolbox	1	0	c1ccc(-c2ccc3[nH+]ccn3n2)cc1,c1ccc(-c2ccc3nccn3[nH+]2)cc1	c1ccc(-c2ccc3nccn3n2)cc1	mol15819	c1ccc(-c2ccc3nccn3n2)cc1