[
  {
    "molid": "mol25411",
    "smiles": "Cn1nc(N=[N+]=[N-])nc1C(=O)O",
    "microspecies": [],
    "macro_pka_values": [
      {
        "pka_value": 3.01,
        "charge_state_pre": 0,
        "charge_state_post": -1,
        "data_source": "AttenGpKa training set"
      }
    ]
  }
]