pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.71	OCHEM	1	0	COc1ccc(C(=O)/C(=N/O)SCC[N+](C)(C)C)cc1	COc1ccc(C(=O)/C(=N/[O-])SCC[N+](C)(C)C)cc1	mol20727	COc1ccc(C(=O)/C(=N/O)SCC[N+](C)(C)C)cc1