pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.93	AttenGpKa training set	0	-1	Cc1cccc(C(=O)NO)c1	Cc1cccc(C(=O)[N-]O)c1,Cc1cccc(C(=O)N[O-])c1	mol31408	Cc1cccc(C(=O)NO)c1