pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.75	Datawarrior	0	-1	Cc1ccc(C)c(NN=C(C#N)C#N)c1	Cc1ccc(C)c([N-]N=C(C#N)C#N)c1	mol14295	Cc1ccc(C)c(NN=C(C#N)C#N)c1
6.9000001	OCHEM	0	-1	Cc1ccc(C)c(NN=C(C#N)C#N)c1	Cc1ccc(C)c([N-]N=C(C#N)C#N)c1	mol14295	Cc1ccc(C)c(NN=C(C#N)C#N)c1
6.90000009536743	QSARToolbox	0	-1	Cc1ccc(C)c(NN=C(C#N)C#N)c1	Cc1ccc(C)c([N-]N=C(C#N)C#N)c1	mol14295	Cc1ccc(C)c(NN=C(C#N)C#N)c1
6.59999990463257	QSARToolbox	0	-1	Cc1ccc(C)c(NN=C(C#N)C#N)c1	Cc1ccc(C)c([N-]N=C(C#N)C#N)c1	mol14295	Cc1ccc(C)c(NN=C(C#N)C#N)c1
-0.84	Datawarrior	1	0	Cc1ccc(C)c([NH2+]N=C(C#N)C#N)c1,Cc1ccc(C)c(N[NH+]=C(C#N)C#N)c1	Cc1ccc(C)c(NN=C(C#N)C#N)c1	mol14295	Cc1ccc(C)c(NN=C(C#N)C#N)c1
-0.83999997	OCHEM	1	0	Cc1ccc(C)c([NH2+]N=C(C#N)C#N)c1,Cc1ccc(C)c(N[NH+]=C(C#N)C#N)c1	Cc1ccc(C)c(NN=C(C#N)C#N)c1	mol14295	Cc1ccc(C)c(NN=C(C#N)C#N)c1