pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
14.59	Baltruschat ChEMBL	0	-1	O=C(O[C@H]1C[C@@H]2C[C@@H]3C[C@@H](C1)N2CC3=O)c1c[nH]c2ccccc12	O=C(O[C@H]1C[C@@H]2C[C@@H]3C[C@@H](C1)N2CC3=O)c1c[n-]c2ccccc12	mol20881	O=C(O[C@H]1CC2C[C@@H]3C[C@@H](C1)N2CC3=O)c1c[nH]c2ccccc12