pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.51	AttenGpKa training set	0	-1	O=C1CNC(=S)N1	O=C1C[N-]C(=S)N1,O=C1CNC(=S)[N-]1	mol27518	O=C1CNC(=S)N1