pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.31	Baltruschat ChEMBL	0	-1	COc1ccc(-c2cc(C(=O)O)n[nH]2)cc1	COc1ccc(-c2cc(C(=O)[O-])n[nH]2)cc1	mol16152	COc1ccc(-c2cc(C(=O)O)n[nH]2)cc1
