pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.74	Datawarrior	0	-1	O=C(O)c1cccc(-c2nnn[nH]2)c1	O=C([O-])c1cccc(-c2nnn[nH]2)c1,O=C(O)c1cccc(-c2nnn[n-]2)c1	mol13366	O=C(O)c1cccc(-c2nnn[nH]2)c1
3.74000000953674	QSARToolbox	0	-1	O=C(O)c1cccc(-c2nnn[nH]2)c1	O=C([O-])c1cccc(-c2nnn[nH]2)c1,O=C(O)c1cccc(-c2nnn[n-]2)c1	mol13366	O=C(O)c1cccc(-c2nnn[nH]2)c1