pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.39	Baltruschat ChEMBL	1	0	OB(O)c1cc2cc(CNC=[OH+])ccc2s1	O=CNCc1ccc2sc(B(O)O)cc2c1	mol17374	O=CNCc1ccc2sc(B(O)O)cc2c1