pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.5300002	OCHEM	0	-1	O=C1C[C@H]2OCC=C3C[NH+]4CC[C@]56c7ccccc7N1[C@@H]5[C@@H]2[C@@]3(S(=O)(=O)[O-])C[C@H]46	O=C1C[C@H]2OCC=C3CN4CC[C@]56c7ccccc7N1[C@@H]5[C@@H]2[C@@]3(S(=O)(=O)[O-])C[C@H]46	mol32677	O=C1CC2OCC=C3CN4CCC56c7ccccc7N1C5C2C3(S(=O)(=O)O)CC46