pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.11	Datawarrior	0	-1	Nc1nc(=S)[nH]c(O)c1C1=CCCCC1	Nc1nc(=S)[nH]c([O-])c1C1=CCCCC1,Nc1nc(=S)[n-]c(O)c1C1=CCCCC1	mol15796	Nc1nc(=S)[nH]c(O)c1C1=CCCCC1
7.1100001	OCHEM	0	-1	Nc1nc(=S)[nH]c(O)c1C1=CCCCC1	Nc1nc(=S)[nH]c([O-])c1C1=CCCCC1,Nc1nc(=S)[n-]c(O)c1C1=CCCCC1	mol15796	Nc1nc(=S)[nH]c(O)c1C1=CCCCC1