pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.47	AttenGpKa training set	1	0	CCOC(=O)c1cc(C2=C[C@H]3CC[C@@H]2[NH2+]3)on1	CCOC(=O)c1cc(C2=C[C@H]3CC[C@@H]2N3)on1	mol24653	CCOC(=O)c1cc(C2=CC3CCC2N3)on1