pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.5	QSARToolbox	1	0	COc1ccc2c(c1)[C@]13CCCC[C@H]1[C@H](C2)[NH+](C)CC3	COc1ccc2c(c1)[C@]13CCCC[C@H]1[C@H](C2)N(C)CC3	mol34631	COc1ccc2c(c1)C13CCCCC1C(C2)N(C)CC3