pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.71	IUPAC digitized pKa	1	0	C[NH+](C)CCC(=O)C(c1ccccc1)c1ccccc1	CN(C)CCC(=O)C(c1ccccc1)c1ccccc1	mol2364	CN(C)CCC(=O)C(c1ccccc1)c1ccccc1
8.71000003814697	QSARToolbox	1	0	C[NH+](C)CCC(=O)C(c1ccccc1)c1ccccc1	CN(C)CCC(=O)C(c1ccccc1)c1ccccc1	mol2364	CN(C)CCC(=O)C(c1ccccc1)c1ccccc1