pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.98999977111816	QSARToolbox	0	-1	O=[N+]([O-])NCCO	O=[N+]([O-])[N-]CCO	mol27833	O=[N+]([O-])NCCO
5.95	AttenGpKa training set	0	-1	O=[N+]([O-])NCCO	O=[N+]([O-])[N-]CCO	mol27833	O=[N+]([O-])NCCO
5.99	AttenGpKa training set	0	-1	O=[N+]([O-])NCCO	O=[N+]([O-])[N-]CCO	mol27833	O=[N+]([O-])NCCO