pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.71	Datawarrior	0	-1	O=S(=O)(NCc1ccccc1)c1ccc(Br)cc1	O=S(=O)([N-]Cc1ccccc1)c1ccc(Br)cc1	mol14952	O=S(=O)(NCc1ccccc1)c1ccc(Br)cc1
10.710000038147	QSARToolbox	0	-1	O=S(=O)(NCc1ccccc1)c1ccc(Br)cc1	O=S(=O)([N-]Cc1ccccc1)c1ccc(Br)cc1	mol14952	O=S(=O)(NCc1ccccc1)c1ccc(Br)cc1
