pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.9	Hunt	0	-1	C[C@H](CO)Nc1nc(SCc2cccc(F)c2F)nc2[nH]c(=O)c(C#N)cc12	C[C@H](CO)Nc1nc(SCc2cccc(F)c2F)nc2[n-]c(=O)c(C#N)cc12	mol600	C[C@H](CO)Nc1nc(SCc2cccc(F)c2F)nc2[nH]c(=O)c(C#N)cc12