pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
1.8	Datawarrior	1	0	Oc1ccc2c(c1)Nc1ccccc1[NH2+]2,Oc1ccc2c(c1)[NH2+]c1ccccc1N2	Oc1ccc2c(c1)Nc1ccccc1N2	mol15810	Oc1ccc2c(c1)Nc1ccccc1N2
1.79999995231628	QSARToolbox	1	0	Oc1ccc2c(c1)Nc1ccccc1[NH2+]2,Oc1ccc2c(c1)[NH2+]c1ccccc1N2	Oc1ccc2c(c1)Nc1ccccc1N2	mol15810	Oc1ccc2c(c1)Nc1ccccc1N2