pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
1.34	Datawarrior	1	0	COc1ccc(-c2[nH+]cc(-c3ccc(C)cc3)o2)cc1	COc1ccc(-c2ncc(-c3ccc(C)cc3)o2)cc1	mol14692	COc1ccc(-c2ncc(-c3ccc(C)cc3)o2)cc1
1.3400000333786	QSARToolbox	1	0	COc1ccc(-c2[nH+]cc(-c3ccc(C)cc3)o2)cc1	COc1ccc(-c2ncc(-c3ccc(C)cc3)o2)cc1	mol14692	COc1ccc(-c2ncc(-c3ccc(C)cc3)o2)cc1