pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.3	Baltruschat ChEMBL	0	-1	Cc1ccc(/C=N/NC(=S)NC2CCCCC2)c(C(=O)O)c1O,Cc1ccc(/C=[NH+]/NC(=S)NC2CCCCC2)c(C(=O)[O-])c1O	Cc1ccc(/C=N/NC(=S)NC2CCCCC2)c(C(=O)[O-])c1O	mol18579	Cc1ccc(/C=N/NC(=S)NC2CCCCC2)c(C(=O)O)c1O