pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.01	Datawarrior	0	-1	Oc1ccc2[nH]cnc2c1	[O-]c1ccc2[nH]cnc2c1	mol13169	Oc1ccc2[nH]cnc2c1
5.69	Datawarrior	1	0	Oc1ccc2[nH]c[nH+]c2c1	Oc1ccc2[nH]cnc2c1	mol13169	Oc1ccc2[nH]cnc2c1
5.6900001	OCHEM	1	0	Oc1ccc2[nH]c[nH+]c2c1	Oc1ccc2[nH]cnc2c1	mol13169	Oc1ccc2[nH]cnc2c1