[
  {
    "molid": "mol35228",
    "smiles": "NC(Cc1ccccc1)P(=O)(O)O",
    "microspecies": [
      {
        "id": "-1_3",
        "charge": -1,
        "smiles": "[NH3+][C@@H](Cc1ccccc1)P(=O)([O-])[O-]",
        "std_free_energy": -14.100186347961426,
        "relative_population": 0.9987520187385995
      },
      {
        "id": "-2_1",
        "charge": -2,
        "smiles": "N[C@@H](Cc1ccccc1)P(=O)([O-])[O-]",
        "std_free_energy": -6.006863594055176,
        "relative_population": 0.9999999843702642
      }
    ],
    "macro_pka_values": [
      {
        "pka_value": 10.7600002288818,
        "charge_state_pre": -1,
        "charge_state_post": -2,
        "data_source": "QSARToolbox"
      }
    ]
  }
]