pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.8	OCHEM	0	-1	Cc1ccc(OCC(=O)N[C@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)cc1	Cc1ccc(OCC(=O)N[C@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)[O-])cc1	mol32359	Cc1ccc(OCC(=O)NC2C(=O)N3C2SC(C)(C)C3C(=O)O)cc1