pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.71999979019165	QSARToolbox	0	-1	Nc1ccn(CCOCP(=O)([O-])O)c(=O)[nH+]1,[NH3+]c1ccn(CCOCP(=O)([O-])O)c(=O)n1	Nc1ccn(CCOCP(=O)([O-])O)c(=O)n1,[NH3+]c1ccn(CCOCP(=O)([O-])[O-])c(=O)n1,Nc1ccn(CCOCP(=O)([O-])[O-])c(=O)[nH+]1	mol34002	Nc1ccn(CCOCP(=O)(O)O)c(=O)n1