pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.09	AttenGpKa training set	1	0	CCC[NH2+]C(C)(C)/C(C)=N/O	CCCNC(C)(C)/C(C)=N/O,CCC[NH2+]C(C)(C)/C(C)=N/[O-]	mol31556	CCCNC(C)(C)/C(C)=N/O