pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.94999980926514	QSARToolbox	1	0	CC(C)[NH+]1CCc2ccccc2C1	CC(C)N1CCc2ccccc2C1	mol24587	CC(C)N1CCc2ccccc2C1
9.1	AttenGpKa training set	1	0	CC(C)[NH+]1CCc2ccccc2C1	CC(C)N1CCc2ccccc2C1	mol24587	CC(C)N1CCc2ccccc2C1