pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.65	IUPAC digitized pKa	1	0	C[NH+]1CCC(c2ccccc2)(c2ccccc2)CC1	CN1CCC(c2ccccc2)(c2ccccc2)CC1	mol1247	CN1CCC(c2ccccc2)(c2ccccc2)CC1
8.64999961853027	QSARToolbox	1	0	C[NH+]1CCC(c2ccccc2)(c2ccccc2)CC1	CN1CCC(c2ccccc2)(c2ccccc2)CC1	mol1247	CN1CCC(c2ccccc2)(c2ccccc2)CC1