pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.53	Datawarrior	0	-1	""	""	mol14408	O=C1C[C@@H]2OCC=C3CN4CC[C@@]56c7ccccc7N1[C@H]5C2[C@@]3(S(=O)(=O)O)C[C@H]46
