pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.63	Baltruschat ChEMBL	0	-1	O=C1C[C@@H](c2ccccc2)CC(O)=C1Sc1ccccc1[N+](=O)[O-]	O=C1C[C@@H](c2ccccc2)CC([O-])=C1Sc1ccccc1[N+](=O)[O-]	mol16673	O=C1CC(c2ccccc2)CC(O)=C1Sc1ccccc1[N+](=O)[O-]