pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.78	IUPAC digitized pKa	0	-1	Cn1c(=S)[nH]c2cc3c(cc21)CCCC3	Cn1c(=S)[n-]c2cc3c(cc21)CCCC3	mol11725	Cn1c(=S)[nH]c2cc3c(cc21)CCCC3
10.65	AttenGpKa training set	0	-1	Cn1c(=S)[nH]c2cc3c(cc21)CCCC3	Cn1c(=S)[n-]c2cc3c(cc21)CCCC3	mol11725	Cn1c(=S)[nH]c2cc3c(cc21)CCCC3