pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.80999994277954	QSARToolbox	1	0	O=[N+]([O-])c1cccc2[nH+]ccc(NC[C@H](O)CO)c12,O=[N+]([O-])c1cccc2nccc([NH2+]C[C@H](O)CO)c12	O=[N+]([O-])c1cccc2nccc(NC[C@H](O)CO)c12	mol36805	O=[N+]([O-])c1cccc2nccc(NCC(O)CO)c12