pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.05999994277954	QSARToolbox	1	0	[NH3+][C@@H](Cc1ccc(O)c(O)c1)C(=O)OCCc1ccccc1	[NH3+][C@@H](Cc1ccc(O)c([O-])c1)C(=O)OCCc1ccccc1,N[C@@H](Cc1ccc(O)c(O)c1)C(=O)OCCc1ccccc1	mol37744	N[C@@H](Cc1ccc(O)c(O)c1)C(=O)OCCc1ccccc1