pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.8	Baltruschat ChEMBL	1	0	CN1C(=O)[C@]2([NH+]=C1N)c1cc(-c3cccnc3F)ccc1O[C@H]1CCOC[C@@H]12,CN1C(=O)[C@]2(N=C1N)c1cc(-c3ccc[nH+]c3F)ccc1O[C@H]1CCOC[C@@H]12	CN1C(=O)[C@]2(N=C1N)c1cc(-c3cccnc3F)ccc1O[C@H]1CCOC[C@@H]12	mol21546	CN1C(=O)[C@]2(N=C1N)c1cc(-c3cccnc3F)ccc1O[C@H]1CCOC[C@@H]12