pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.2	Datawarrior	0	-1	CC(CC[NH+](C)C)=N[O-],CC(CCN(C)C)=NO	CC(CCN(C)C)=N[O-]	mol13494	CC(CCN(C)C)=NO
11.1999998092651	QSARToolbox	0	-1	CC(CC[NH+](C)C)=N[O-],CC(CCN(C)C)=NO	CC(CCN(C)C)=N[O-]	mol13494	CC(CCN(C)C)=NO
