pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.69999980926514	QSARToolbox	1	0	ClCCN(CCCl)CC[NH+](Cc1ccccc1)Cc1ccccc1,ClCC[NH+](CCCl)CCN(Cc1ccccc1)Cc1ccccc1	ClCCN(CCCl)CCN(Cc1ccccc1)Cc1ccccc1	mol38401	ClCCN(CCCl)CCN(Cc1ccccc1)Cc1ccccc1