pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.19999980926514	QSARToolbox	1	0	O=C(CCC[NH+]1CCC(O)(c2ccc(Cl)cc2)CC1)c1ccccc1	O=C(CCCN1CCC(O)(c2ccc(Cl)cc2)CC1)c1ccccc1	mol36781	O=C(CCCN1CCC(O)(c2ccc(Cl)cc2)CC1)c1ccccc1