pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.49000000953674	QSARToolbox	1	0	[NH3+][C@H](CCC(=O)OCc1ccccc1)C(=O)O	[NH3+][C@H](CCC(=O)OCc1ccccc1)C(=O)[O-]	mol38530	NC(CCC(=O)OCc1ccccc1)C(=O)O