pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.41	OCHEM	1	0	C[NH+](C)CCCS/C(=N\O)C(=O)c1ccc(Br)cc1	C[NH+](C)CCCS/C(=N\[O-])C(=O)c1ccc(Br)cc1,CN(C)CCCS/C(=N\O)C(=O)c1ccc(Br)cc1	mol20741	CN(C)CCCS/C(=N\O)C(=O)c1ccc(Br)cc1