pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.57	Datawarrior	1	0	C(=C\c1cc[nH+]cc1)\c1ccncc1	C(=C\c1ccncc1)\c1ccncc1	mol13376	C(=C\c1ccncc1)\c1ccncc1
5.57000017166138	QSARToolbox	1	0	C(=C\c1cc[nH+]cc1)\c1ccncc1	C(=C\c1ccncc1)\c1ccncc1	mol13376	C(=C\c1ccncc1)\c1ccncc1
