[
  {
    "molid": "mol32464",
    "smiles": "CN(C)C=Nc1cccc(O)c1",
    "microspecies": [
      {
        "id": "0_1",
        "charge": 0,
        "smiles": "CN(C)C=Nc1cccc(O)c1",
        "std_free_energy": -3.8308191299438477,
        "relative_population": 0.4550174478703173
      },
      {
        "id": "0_2",
        "charge": 0,
        "smiles": "CN(C)C=[NH+]c1cccc([O-])c1",
        "std_free_energy": -4.011237144470215,
        "relative_population": 0.5449825521296826
      },
      {
        "id": "1_1",
        "charge": 1,
        "smiles": "CN(C)C=[NH+]c1cccc(O)c1",
        "std_free_energy": -8.090234756469727,
        "relative_population": 1.0
      },
      {
        "id": "-1_1",
        "charge": -1,
        "smiles": "CN(C)C=Nc1cccc([O-])c1",
        "std_free_energy": 3.775498628616333,
        "relative_population": 1.0
      }
    ],
    "macro_pka_values": [
      {
        "pka_value": 10.23,
        "charge_state_pre": 0,
        "charge_state_post": -1,
        "data_source": "OCHEM"
      },
      {
        "pka_value": 7.8800001,
        "charge_state_pre": 1,
        "charge_state_post": 0,
        "data_source": "OCHEM"
      }
    ]
  }
]