pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.51	Datawarrior	1	0	[OH+]=C(/C=C(/[70SH])c1ccccc1)Nc1ccccc1	O=C(/C=C(/[70SH])c1ccccc1)Nc1ccccc1	mol14962	O=C(/C=C(/[70SH])c1ccccc1)Nc1ccccc1