pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.29	OCHEM	0	-1	C[NH+](C)CCCCCNC(=O)C=N[O-],CN(C)CCCCCNC(=O)C=NO	CN(C)CCCCCNC(=O)C=N[O-],CN(C)CCCCC[N-]C(=O)C=NO	mol32568	CN(C)CCCCCNC(=O)C=NO
8.8800001	OCHEM	1	0	C[NH+](C)CCCCCNC(=O)C=NO	C[NH+](C)CCCCCNC(=O)C=N[O-],CN(C)CCCCCNC(=O)C=NO	mol32568	CN(C)CCCCCNC(=O)C=NO
8.88000011444092	QSARToolbox	1	0	C[NH+](C)CCCCCNC(=O)C=NO	C[NH+](C)CCCCCNC(=O)C=N[O-],CN(C)CCCCCNC(=O)C=NO	mol32568	CN(C)CCCCCNC(=O)C=NO