pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.9	IUPAC digitized pKa	1	0	CCC[NH+](CCCO)C[C@@H](C)O	CCCN(CCCO)C[C@@H](C)O	mol5890	CCCN(CCCO)CC(C)O
8.4	IUPAC digitized pKa	1	0	CCC[NH+](CCCO)C[C@@H](C)O	CCCN(CCCO)C[C@@H](C)O	mol5890	CCCN(CCCO)CC(C)O
8.1	IUPAC digitized pKa	1	0	CCC[NH+](CCCO)C[C@@H](C)O	CCCN(CCCO)C[C@@H](C)O	mol5890	CCCN(CCCO)CC(C)O