pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.0	AttenGpKa training set	0	-1	CC(C)(C)OC(=O)NCc1nc(=O)[nH]c(=O)[nH]1	CC(C)(C)OC(=O)NCc1nc(=O)[nH]c(=O)[n-]1,CC(C)(C)OC(=O)NCc1nc(=O)[n-]c(=O)[nH]1	mol29644	CC(C)(C)OC(=O)NCc1nc(=O)[nH]c(=O)[nH]1
