pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.0	Baltruschat ChEMBL	0	-1	N#Cc1c(-c2ccc(C(=O)NS(=O)(=O)c3ccccc3)cc2)c2c([nH]c1=O)-c1ccccc1OC2	N#Cc1c(-c2ccc(C(=O)[N-]S(=O)(=O)c3ccccc3)cc2)c2c([nH]c1=O)-c1ccccc1OC2	mol16745	N#Cc1c(-c2ccc(C(=O)NS(=O)(=O)c3ccccc3)cc2)c2c([nH]c1=O)-c1ccccc1OC2
