pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
1.82	Datawarrior	1	0	O=C(N/[NH+]=C/c1ccccc1)c1ccncc1,O=C(N/N=C/c1ccccc1)c1cc[nH+]cc1	O=C(N/N=C/c1ccccc1)c1ccncc1	mol15221	O=C(N/N=C/c1ccccc1)c1ccncc1
1.82000005245209	QSARToolbox	1	0	O=C(N/[NH+]=C/c1ccccc1)c1ccncc1,O=C(N/N=C/c1ccccc1)c1cc[nH+]cc1	O=C(N/N=C/c1ccccc1)c1ccncc1	mol15221	O=C(N/N=C/c1ccccc1)c1ccncc1