pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.21	IUPAC digitized pKa	0	-1	CC(C)[NH2+]C[C@@H](O)c1cccc([O-])c1,CC(C)NC[C@@H](O)c1cccc(O)c1	CC(C)NC[C@@H](O)c1cccc([O-])c1	mol6205	CC(C)NCC(O)c1cccc(O)c1
9.09	IUPAC digitized pKa	1	0	CC(C)[NH2+]C[C@@H](O)c1cccc(O)c1	CC(C)[NH2+]C[C@@H](O)c1cccc([O-])c1,CC(C)NC[C@@H](O)c1cccc(O)c1	mol6205	CC(C)NCC(O)c1cccc(O)c1