pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.3	Baltruschat ChEMBL	1	0	COc1ccc2c(c[n+](C)c3c4cc5c(cc4ccc23)OCO5)c1O	COc1ccc2c(c[n+](C)c3c4cc5c(cc4ccc23)OCO5)c1[O-]	mol16655	COc1ccc2c(c[n+](C)c3c4cc5c(cc4ccc23)OCO5)c1O