pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.4	AttenGpKa training set	1	0	CC[NH2+]CCS/C(=N\O)C(C)=O	CC[NH2+]CCS/C(=N\[O-])C(C)=O,CCNCCS/C(=N\O)C(C)=O	mol31604	CCNCCS/C(=N\O)C(C)=O