pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.93	Datawarrior	1	0	c1c[nH+]cc(-c2ccoc2)c1	c1cncc(-c2ccoc2)c1	mol14013	c1cncc(-c2ccoc2)c1
4.9299998	OCHEM	1	0	c1c[nH+]cc(-c2ccoc2)c1	c1cncc(-c2ccoc2)c1	mol14013	c1cncc(-c2ccoc2)c1
4.92999982833862	QSARToolbox	1	0	c1c[nH+]cc(-c2ccoc2)c1	c1cncc(-c2ccoc2)c1	mol14013	c1cncc(-c2ccoc2)c1