pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.09999990463257	QSARToolbox	0	-1	CNC(=O)CNC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)CNC(C)=O	CNC(=O)CNC(=O)CNC(=O)[C@H](CC(=O)[O-])NC(=O)CNC(C)=O	mol37402	CNC(=O)CNC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)CNC(C)=O