[
  {
    "molid": "mol34790",
    "smiles": "CC(N)(c1ccccc1)P(=O)(O)O",
    "microspecies": [
      {
        "id": "0_2",
        "charge": 0,
        "smiles": "C[C@@]([NH3+])(c1ccccc1)P(=O)([O-])O",
        "std_free_energy": -11.539115905761719,
        "relative_population": 0.9999937031653562
      },
      {
        "id": "-1_1",
        "charge": -1,
        "smiles": "C[C@@]([NH3+])(c1ccccc1)P(=O)([O-])[O-]",
        "std_free_energy": -14.249011039733887,
        "relative_population": 0.9987017687628141
      }
    ],
    "macro_pka_values": [
      {
        "pka_value": 6.03999996185303,
        "charge_state_pre": 0,
        "charge_state_post": -1,
        "data_source": "QSARToolbox"
      }
    ]
  }
]