pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.1	Datawarrior	1	0	Cn1c(=N[NH3+])sc2ccccc21,Cn1c(=[NH+]N)sc2ccccc21	Cn1c(=NN)sc2ccccc21	mol12851	Cn1c(=NN)sc2ccccc21
6.0999999	OCHEM	1	0	Cn1c(=N[NH3+])sc2ccccc21,Cn1c(=[NH+]N)sc2ccccc21	Cn1c(=NN)sc2ccccc21	mol12851	Cn1c(=NN)sc2ccccc21
6.09999990463257	QSARToolbox	1	0	Cn1c(=N[NH3+])sc2ccccc21,Cn1c(=[NH+]N)sc2ccccc21	Cn1c(=NN)sc2ccccc21	mol12851	Cn1c(=NN)sc2ccccc21