pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.9	Baltruschat ChEMBL	0	-1	C[C@H](CO)Nc1cc(NS(C)(=O)=O)nc(SCc2ccccc2)n1	C[C@H](CO)Nc1cc([N-]S(C)(=O)=O)nc(SCc2ccccc2)n1	mol18183	C[C@H](CO)Nc1cc(NS(C)(=O)=O)nc(SCc2ccccc2)n1