pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.4	Datawarrior	0	-1	CCCCCc1c(-c2ccccc2)n[nH]c1O	CCCCCc1c(-c2ccccc2)n[nH]c1[O-],CCCCCc1c(-c2ccccc2)n[n-]c1O	mol15157	CCCCCc1c(-c2ccccc2)n[nH]c1O
8.3999996	OCHEM	0	-1	CCCCCc1c(-c2ccccc2)n[nH]c1O	CCCCCc1c(-c2ccccc2)n[nH]c1[O-],CCCCCc1c(-c2ccccc2)n[n-]c1O	mol15157	CCCCCc1c(-c2ccccc2)n[nH]c1O