pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.08	IUPAC digitized pKa	1	0	[NH2+]=C(c1ccccc1)c1cccc(O)c1	[NH2+]=C(c1ccccc1)c1cccc([O-])c1,N=C(c1ccccc1)c1cccc(O)c1	mol3467	N=C(c1ccccc1)c1cccc(O)c1
6.92	Datawarrior	1	0	[NH2+]=C(c1ccccc1)c1cccc(O)c1	[NH2+]=C(c1ccccc1)c1cccc([O-])c1,N=C(c1ccccc1)c1cccc(O)c1	mol3467	N=C(c1ccccc1)c1cccc(O)c1
6.9200001	OCHEM	1	0	[NH2+]=C(c1ccccc1)c1cccc(O)c1	[NH2+]=C(c1ccccc1)c1cccc([O-])c1,N=C(c1ccccc1)c1cccc(O)c1	mol3467	N=C(c1ccccc1)c1cccc(O)c1
7.0	OCHEM	1	0	[NH2+]=C(c1ccccc1)c1cccc(O)c1	[NH2+]=C(c1ccccc1)c1cccc([O-])c1,N=C(c1ccccc1)c1cccc(O)c1	mol3467	N=C(c1ccccc1)c1cccc(O)c1