pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.1999998	OCHEM	0	-1	Oc1ccc(N=Nc2nc3ccccc3s2)c2cccnc12,[O-]c1ccc(N=Nc2nc3ccccc3s2)c2ccc[nH+]c12	[O-]c1ccc(N=Nc2nc3ccccc3s2)c2cccnc12	mol32347	Oc1ccc(N=Nc2nc3ccccc3s2)c2cccnc12
7.19999980926514	QSARToolbox	0	-1	Oc1ccc(N=Nc2nc3ccccc3s2)c2cccnc12,[O-]c1ccc(N=Nc2nc3ccccc3s2)c2ccc[nH+]c12	[O-]c1ccc(N=Nc2nc3ccccc3s2)c2cccnc12	mol32347	Oc1ccc(N=Nc2nc3ccccc3s2)c2cccnc12