pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
1.25	Datawarrior	1	0	COc1ccc(-c2[nH+]cc(-c3ccccc3)o2)cc1	COc1ccc(-c2ncc(-c3ccccc3)o2)cc1	mol15546	COc1ccc(-c2ncc(-c3ccccc3)o2)cc1