pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.41	Datawarrior	1	0	C[NH2+]c1cccnc1,CNc1ccc[nH+]c1	CNc1cccnc1	mol12367	CNc1cccnc1
6.4099998	OCHEM	1	0	C[NH2+]c1cccnc1,CNc1ccc[nH+]c1	CNc1cccnc1	mol12367	CNc1cccnc1
-2.17	Datawarrior	2	1	C[NH2+]c1ccc[nH+]c1	C[NH2+]c1cccnc1,CNc1ccc[nH+]c1	mol12367	CNc1cccnc1