pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.57999992370605	QSARToolbox	0	-1	O=C(O)[C@H](c1ccccc1)[C@H](C(=O)O)c1ccccc1	O=C([O-])[C@H](c1ccccc1)[C@H](C(=O)O)c1ccccc1	mol37242	O=C(O)[C@H](c1ccccc1)[C@H](C(=O)O)c1ccccc1