pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.24	IUPAC digitized pKa	1	0	CN(C)c1c[nH+]ccn1,CN(C)c1cncc[nH+]1,C[NH+](C)c1cnccn1	CN(C)c1cnccn1	mol3987	CN(C)c1cnccn1
3.24000000953674	QSARToolbox	1	0	CN(C)c1c[nH+]ccn1,CN(C)c1cncc[nH+]1,C[NH+](C)c1cnccn1	CN(C)c1cnccn1	mol3987	CN(C)c1cnccn1
