pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.04	euroSAMPL1	0	-1	CSCc1ccc(C(=O)O)cc1	CSCc1ccc(C(=O)[O-])cc1	euroSAMPL-34	CSCc1ccc(C(=O)O)cc1