pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
0.41	Datawarrior	1	0	Clc1ccc(-c2[nH+]cc(-c3ccccc3)o2)cc1	Clc1ccc(-c2ncc(-c3ccccc3)o2)cc1	mol14841	Clc1ccc(-c2ncc(-c3ccccc3)o2)cc1
0.409999996423721	QSARToolbox	1	0	Clc1ccc(-c2[nH+]cc(-c3ccccc3)o2)cc1	Clc1ccc(-c2ncc(-c3ccccc3)o2)cc1	mol14841	Clc1ccc(-c2ncc(-c3ccccc3)o2)cc1