pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.02999973297119	QSARToolbox	0	-1	CC(C)[C@@H](C(=O)[O-])[NH+](C)Cc1cccc(C[NH+](C)[C@@H](C(=O)[O-])C(C)C)n1	CC(C)[C@@H](C(=O)[O-])[NH+](C)Cc1cccc(CN(C)[C@@H](C(=O)[O-])C(C)C)n1	mol35062	CC(C)C(C(=O)O)N(C)Cc1cccc(CN(C)C(C(=O)O)C(C)C)n1