pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.1	Datawarrior	1	0	C=CC(C)(C)[NH2+]C(C)(C)C=C	C=CC(C)(C)NC(C)(C)C=C	mol1469	C=CC(C)(C)NC(C)(C)C=C
10.1000003814697	QSARToolbox	1	0	C=CC(C)(C)[NH2+]C(C)(C)C=C	C=CC(C)(C)NC(C)(C)C=C	mol1469	C=CC(C)(C)NC(C)(C)C=C
