pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.6	AttenGpKa training set	1	0	Cc1cc2[nH]c(C(C)C)[nH+]c2cc1C	Cc1cc2nc(C(C)C)[nH]c2cc1C	mol26480	Cc1cc2nc(C(C)C)[nH]c2cc1C