pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.31	IUPAC digitized pKa	1	0	C[NH2+]C[C@@H](O)c1ccccc1	CNC[C@@H](O)c1ccccc1	mol3470	CNCC(O)c1ccccc1
9.44	IUPAC digitized pKa	1	0	C[NH2+]C[C@@H](O)c1ccccc1	CNC[C@@H](O)c1ccccc1	mol3470	CNCC(O)c1ccccc1
9.37	IUPAC digitized pKa	1	0	C[NH2+]C[C@@H](O)c1ccccc1	CNC[C@@H](O)c1ccccc1	mol3470	CNCC(O)c1ccccc1
9.3100004	OCHEM	1	0	C[NH2+]C[C@@H](O)c1ccccc1	CNC[C@@H](O)c1ccccc1	mol3470	CNCC(O)c1ccccc1