pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.13	AttenGpKa training set	1	0	COc1ccc2[nH+]c3ccccc3c(Sc3ccccc3)c2c1	COc1ccc2nc3ccccc3c(Sc3ccccc3)c2c1	mol26753	COc1ccc2nc3ccccc3c(Sc3ccccc3)c2c1