pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.67	IUPAC digitized pKa	1	0	C[NH2+]CCOC(c1ccccc1)c1ccccc1	CNCCOC(c1ccccc1)c1ccccc1	mol3144	CNCCOC(c1ccccc1)c1ccccc1
9.12	IUPAC digitized pKa	1	0	C[NH2+]CCOC(c1ccccc1)c1ccccc1	CNCCOC(c1ccccc1)c1ccccc1	mol3144	CNCCOC(c1ccccc1)c1ccccc1
9.0	IUPAC digitized pKa	1	0	C[NH2+]CCOC(c1ccccc1)c1ccccc1	CNCCOC(c1ccccc1)c1ccccc1	mol3144	CNCCOC(c1ccccc1)c1ccccc1
8.98	IUPAC digitized pKa	1	0	C[NH2+]CCOC(c1ccccc1)c1ccccc1	CNCCOC(c1ccccc1)c1ccccc1	mol3144	CNCCOC(c1ccccc1)c1ccccc1