pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.98	Datawarrior	0	-1	CCN(CC)CC(C)=NO,CC[NH+](CC)CC(C)=N[O-]	CCN(CC)CC(C)=N[O-]	mol13112	CCN(CC)CC(C)=NO
10.9799995422363	QSARToolbox	0	-1	CCN(CC)CC(C)=NO,CC[NH+](CC)CC(C)=N[O-]	CCN(CC)CC(C)=N[O-]	mol13112	CCN(CC)CC(C)=NO
