pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.12	Baltruschat ChEMBL	0	-1	O=C(NCCCCCCCNC(=O)NS(=O)(=O)c1cccc(Cl)c1)NS(=O)(=O)c1cccc(Cl)c1	O=C([N-]S(=O)(=O)c1cccc(Cl)c1)NCCCCCCCNC(=O)NS(=O)(=O)c1cccc(Cl)c1	mol19943	O=C(NCCCCCCCNC(=O)NS(=O)(=O)c1cccc(Cl)c1)NS(=O)(=O)c1cccc(Cl)c1