pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.82	AttenGpKa training set	1	0	CC[NH+](C)CCS/C(=N\O)C(=O)c1ccc(OC)cc1	CCN(C)CCS/C(=N\O)C(=O)c1ccc(OC)cc1,CC[NH+](C)CCS/C(=N\[O-])C(=O)c1ccc(OC)cc1	mol31646	CCN(C)CCS/C(=N\O)C(=O)c1ccc(OC)cc1