pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.6	AttenGpKa training set	0	-1	Fc1cccc2[nH]cnc12	Fc1cccc2[n-]cnc12	mol7787	Fc1cccc2[nH]cnc12
4.4	IUPAC digitized pKa	1	0	Fc1cccc2[nH]c[nH+]c12	Fc1cccc2[nH]cnc12	mol7787	Fc1cccc2[nH]cnc12
4.4000001	OCHEM	1	0	Fc1cccc2[nH]c[nH+]c12	Fc1cccc2[nH]cnc12	mol7787	Fc1cccc2[nH]cnc12
4.2	AttenGpKa training set	1	0	Fc1cccc2[nH]c[nH+]c12	Fc1cccc2[nH]cnc12	mol7787	Fc1cccc2[nH]cnc12