pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.72000026702881	QSARToolbox	1	0	CCCCNCc1ccc2ccc3ccc(C[NH2+]CCCC)nc3c2n1,CCCCNCc1ccc2ccc3ccc(CNCCCC)[nH+]c3c2n1	CCCCNCc1ccc2ccc3ccc(CNCCCC)nc3c2n1	mol35403	CCCCNCc1ccc2ccc3ccc(CNCCCC)nc3c2n1