pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.47	OCHEM	0	-1	CN(C)CCCCCCCNC(=O)C=NO,C[NH+](C)CCCCCCCNC(=O)C=N[O-]	CN(C)CCCCCCCNC(=O)C=N[O-],CN(C)CCCCCCC[N-]C(=O)C=NO	mol32303	CN(C)CCCCCCCNC(=O)C=NO
8.9799995	OCHEM	1	0	C[NH+](C)CCCCCCCNC(=O)C=NO	CN(C)CCCCCCCNC(=O)C=NO,C[NH+](C)CCCCCCCNC(=O)C=N[O-]	mol32303	CN(C)CCCCCCCNC(=O)C=NO
8.97999954223633	QSARToolbox	1	0	C[NH+](C)CCCCCCCNC(=O)C=NO	CN(C)CCCCCCCNC(=O)C=NO,C[NH+](C)CCCCCCCNC(=O)C=N[O-]	mol32303	CN(C)CCCCCCCNC(=O)C=NO