pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.12	Hunt	1	0	CCC(=O)C(c1ccccc1)(c1ccccc1)[C@H](C)C[NH+]1CCOCC1	CCC(=O)C(c1ccccc1)(c1ccccc1)[C@H](C)CN1CCOCC1	mol1329	CCC(=O)C(c1ccccc1)(c1ccccc1)[C@H](C)CN1CCOCC1