pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.18	OCHEM	0	-1	O=c1[nH]c2cc(Cl)ccc2o1	O=c1[n-]c2cc(Cl)ccc2o1	mol26438	O=c1[nH]c2cc(Cl)ccc2o1
8.3	AttenGpKa training set	0	-1	O=c1[nH]c2cc(Cl)ccc2o1	O=c1[n-]c2cc(Cl)ccc2o1	mol26438	O=c1[nH]c2cc(Cl)ccc2o1
8.26	AttenGpKa training set	0	-1	O=c1[nH]c2cc(Cl)ccc2o1	O=c1[n-]c2cc(Cl)ccc2o1	mol26438	O=c1[nH]c2cc(Cl)ccc2o1