pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
1.15	Hunt	1	0	CSc1c(I)cc([NH3+])cc1I	CSc1c(I)cc(N)cc1I	mol1672	CSc1c(I)cc(N)cc1I
1.14999997615814	QSARToolbox	1	0	CSc1c(I)cc([NH3+])cc1I	CSc1c(I)cc(N)cc1I	mol1672	CSc1c(I)cc(N)cc1I
