pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
0.91	Datawarrior	1	0	Cc1ccc(-c2c[nH+]c(-c3ccccc3)o2)cc1	Cc1ccc(-c2cnc(-c3ccccc3)o2)cc1	mol14839	Cc1ccc(-c2cnc(-c3ccccc3)o2)cc1
0.91000003	OCHEM	1	0	Cc1ccc(-c2c[nH+]c(-c3ccccc3)o2)cc1	Cc1ccc(-c2cnc(-c3ccccc3)o2)cc1	mol14839	Cc1ccc(-c2cnc(-c3ccccc3)o2)cc1
0.910000026226044	QSARToolbox	1	0	Cc1ccc(-c2c[nH+]c(-c3ccccc3)o2)cc1	Cc1ccc(-c2cnc(-c3ccccc3)o2)cc1	mol14839	Cc1ccc(-c2cnc(-c3ccccc3)o2)cc1