pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.09999990463257	QSARToolbox	2	1	ClCC[NH+](CCCl)CC[NH+](C1CCCCC1)C1CCCCC1	ClCCN(CCCl)CC[NH+](C1CCCCC1)C1CCCCC1	mol38400	ClCCN(CCCl)CCN(C1CCCCC1)C1CCCCC1