pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.72	OCHEM	1	0	CC[N+](C)(CC)CCS/C(=N\O)C(=O)c1ccc(C#N)cc1	CC[N+](C)(CC)CCS/C(=N\[O-])C(=O)c1ccc(C#N)cc1	mol20738	CC[N+](C)(CC)CCS/C(=N\O)C(=O)c1ccc(C#N)cc1