pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.0	OCHEM	0	-1	O=C(O)CSCC(=O)Nc1nc(-c2ccccc2)c(-c2ccccc2)s1	O=C([O-])CSCC(=O)Nc1nc(-c2ccccc2)c(-c2ccccc2)s1	mol360	O=C(O)CSCC(=O)Nc1nc(-c2ccccc2)c(-c2ccccc2)s1