pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.93	AttenGpKa training set	0	-1	Cc1cc(NC(=O)C2=C(O)c3ccccc3S(=O)(=O)N2C)no1	Cc1cc([N-]C(=O)C2=C(O)c3ccccc3S(=O)(=O)N2C)no1,Cc1cc(NC(=O)C2=C([O-])c3ccccc3S(=O)(=O)N2C)no1	mol29892	Cc1cc(NC(=O)C2=C(O)c3ccccc3S(=O)(=O)N2C)no1