pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.35	Datawarrior	1	0	C[NH+]1CCC=C(C#N)C1	CN1CCC=C(C#N)C1	mol13590	CN1CCC=C(C#N)C1
6.3499999	OCHEM	1	0	C[NH+]1CCC=C(C#N)C1	CN1CCC=C(C#N)C1	mol13590	CN1CCC=C(C#N)C1