pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.3000001907349	QSARToolbox	-1	-2	CC[C@](C)(S)[C@H](NC(C)=O)C(=O)[O-]	CC[C@](C)([S-])[C@H](NC(C)=O)C(=O)[O-],CC[C@](C)(S)[C@H]([N-]C(C)=O)C(=O)[O-]	mol37454	CCC(C)(S)[C@H](NC(C)=O)C(=O)O