pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.63	AttenGpKa training set	0	-1	CC(=O)N(c1ccc2ccccc2c1)[C@H](C)C(=O)O	CC(=O)N(c1ccc2ccccc2c1)[C@H](C)C(=O)[O-]	mol22509	CC(=O)N(c1ccc2ccccc2c1)C(C)C(=O)O