pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
13.74	Baltruschat ChEMBL	-1	-2	CCc1ccc(CCOc2ccc(C[C@H]3SC(=O)[N-]C3=O)cc2)nc1	""	mol20872	CCc1ccc(CCOc2ccc(CC3SC(=O)NC3=O)cc2)nc1