pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.83	AttenGpKa training set	1	0	CN(Cc1ccccc1)[P@](C)(=[OH+])S	CN(Cc1ccccc1)[P@](C)(=O)S	mol28983	CN(Cc1ccccc1)P(C)(=O)S