pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
1.23	Datawarrior	1	0	Cc1ccccc1-n1nn[nH+]c1N,Cc1ccccc1-n1nnnc1[NH3+]	Cc1ccccc1-n1nnnc1N	mol4307	Cc1ccccc1-n1nnnc1N
1.23000001907349	QSARToolbox	1	0	Cc1ccccc1-n1nn[nH+]c1N,Cc1ccccc1-n1nnnc1[NH3+]	Cc1ccccc1-n1nnnc1N	mol4307	Cc1ccccc1-n1nnnc1N