pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.94	AttenGpKa training set	0	-1	Cc1cc(-c2ccccc2O)n(-c2ccccc2)n1	Cc1cc(-c2ccccc2[O-])n(-c2ccccc2)n1	mol25578	Cc1cc(-c2ccccc2O)n(-c2ccccc2)n1
