pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.02	IUPAC digitized pKa	0	-1	Oc1ccc(Br)c2cccnc12	[O-]c1ccc(Br)c2cccnc12	mol7720	Oc1ccc(Br)c2cccnc12
9.19999980926514	QSARToolbox	0	-1	Oc1ccc(Br)c2cccnc12	[O-]c1ccc(Br)c2cccnc12	mol7720	Oc1ccc(Br)c2cccnc12
3.67	IUPAC digitized pKa	1	0	Oc1ccc(Br)c2ccc[nH+]c12	Oc1ccc(Br)c2cccnc12	mol7720	Oc1ccc(Br)c2cccnc12
3.67000007629395	QSARToolbox	1	0	Oc1ccc(Br)c2ccc[nH+]c12	Oc1ccc(Br)c2cccnc12	mol7720	Oc1ccc(Br)c2cccnc12