pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.38000011444092	QSARToolbox	1	0	FC(F)(F)c1cccc2cnc[nH+]c12,FC(F)(F)c1cccc2c[nH+]cnc12	FC(F)(F)c1cccc2cncnc12	mol7928	FC(F)(F)c1cccc2cncnc12
2.38	AttenGpKa training set	1	0	FC(F)(F)c1cccc2cnc[nH+]c12,FC(F)(F)c1cccc2c[nH+]cnc12	FC(F)(F)c1cccc2cncnc12	mol7928	FC(F)(F)c1cccc2cncnc12