[
  {
    "molid": "mol35579",
    "smiles": "Cc1ccc(Nc2nnn[nH]2)cc1Cl",
    "microspecies": [
      {
        "id": "0_1",
        "charge": 0,
        "smiles": "Cc1ccc(Nc2nnn[nH]2)cc1Cl",
        "std_free_energy": -5.302272796630859,
        "relative_population": 1.0
      },
      {
        "id": "-1_2",
        "charge": -1,
        "smiles": "Cc1ccc(Nc2nnn[n-]2)cc1Cl",
        "std_free_energy": -6.677517414093018,
        "relative_population": 0.9897560089676186
      }
    ],
    "macro_pka_values": [
      {
        "pka_value": 5.66800022125244,
        "charge_state_pre": 0,
        "charge_state_post": -1,
        "data_source": "QSARToolbox"
      }
    ]
  }
]