pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
0.02	Datawarrior	1	0	O=Cc1ccc(-c2[nH+]cc(-c3ccccc3)o2)cc1	O=Cc1ccc(-c2ncc(-c3ccccc3)o2)cc1	mol15545	O=Cc1ccc(-c2ncc(-c3ccccc3)o2)cc1
0.0199999995529652	QSARToolbox	1	0	O=Cc1ccc(-c2[nH+]cc(-c3ccccc3)o2)cc1	O=Cc1ccc(-c2ncc(-c3ccccc3)o2)cc1	mol15545	O=Cc1ccc(-c2ncc(-c3ccccc3)o2)cc1