pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.82	Datawarrior	1	0	C(=C/c1cc[nH+]cc1)\c1ccncc1	C(=C/c1ccncc1)\c1ccncc1	mol6548	C(=C/c1ccncc1)\c1ccncc1
5.82000017166138	QSARToolbox	1	0	C(=C/c1cc[nH+]cc1)\c1ccncc1	C(=C/c1ccncc1)\c1ccncc1	mol6548	C(=C/c1ccncc1)\c1ccncc1