pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.0	Baltruschat ChEMBL	1	0	[NH3+]CCCCCCNS(=O)(=O)c1cccc2c(Cl)cccc12	NCCCCCCNS(=O)(=O)c1cccc2c(Cl)cccc12	mol21040	NCCCCCCNS(=O)(=O)c1cccc2c(Cl)cccc12