pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.77	Datawarrior	1	0	C(=C\c1cc[nH+]cc1)\c1ccccc1	C(=C\c1ccncc1)\c1ccccc1	mol13410	C(=C\c1ccncc1)\c1ccccc1
5.76999998092651	QSARToolbox	1	0	C(=C\c1cc[nH+]cc1)\c1ccccc1	C(=C\c1ccncc1)\c1ccccc1	mol13410	C(=C\c1ccncc1)\c1ccccc1
