pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.70000004768372	QSARToolbox	1	0	O/N=C1/C=C/C(=[NH+]\O)c2cccnc21,O/N=C1/C=C/C(=N\O)c2ccc[nH+]c21,O/N=C1\C=C/C(=[NH+]/O)c2ncccc21	O/N=C1/C=C/C(=N\O)c2cccnc21	mol37358	O/N=C1/C=C/C(=N\O)c2cccnc21