pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.11999988555908	QSARToolbox	0	-1	COc1cc2c(c(OC)c1O)-c1ccc(O)c(=O)cc1[C@@H](NC(C)=O)CC2	COc1cc2c(c(OC)c1[O-])-c1ccc(O)c(=O)cc1[C@@H](NC(C)=O)CC2,COc1cc2c(c(OC)c1O)-c1ccc([O-])c(=O)cc1[C@@H](NC(C)=O)CC2	mol33978	COc1cc2c(c(OC)c1O)-c1ccc(O)c(=O)cc1[C@@H](NC(C)=O)CC2