pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.0	QSARToolbox	0	-1	CN(CCC(=O)[O-])c1cc[nH+]cc1,C[NH+](CCC(=O)[O-])c1ccncc1	CN(CCC(=O)[O-])c1ccncc1	mol36432	CN(CCC(=O)O)c1ccncc1