pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.775	AttenGpKa training set	1	0	CN(C)c1ccc(C[NH3+])cc1	CN(C)c1ccc(CN)cc1	mol24256	CN(C)c1ccc(CN)cc1
4.09999990463257	QSARToolbox	2	1	C[NH+](C)c1ccc(C[NH3+])cc1	CN(C)c1ccc(C[NH3+])cc1	mol24256	CN(C)c1ccc(CN)cc1
