pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.42000007629395	QSARToolbox	1	0	O[C@H]1c2ccc3nc4ccc5ccccc5c4cc3c2[C@@H]2O[C@@H]2[C@@H]1[OH2+],O[C@H]1[C@H]2O[C@H]2c2c(ccc3nc4ccc5ccccc5c4cc23)[C@@H]1[OH2+],O[C@H]1[C@H]2O[C@H]2c2c(ccc3[nH+]c4ccc5ccccc5c4cc23)[C@@H]1O	O[C@H]1[C@H]2O[C@H]2c2c(ccc3nc4ccc5ccccc5c4cc23)[C@@H]1O	mol37316	O[C@H]1[C@H]2O[C@H]2c2c(ccc3nc4ccc5ccccc5c4cc23)[C@@H]1O