pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.02999997138977	QSARToolbox	0	-1	O=C1CC[C@@H](C(=O)N2CSC[C@H]2C(=O)O)N1	O=C1CC[C@@H](C(=O)N2CSC[C@H]2C(=O)[O-])N1	mol34079	O=C1CC[C@@H](C(=O)N2CSC[C@H]2C(=O)O)N1