[
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    "molid": "mol5375",
    "smiles": "NCC(=O)NCC(=O)O",
    "microspecies": [
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        "id": "0_1",
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      {
        "id": "-1_1",
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        "id": "-2_1",
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    "macro_pka_values": [
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        "data_source": "IUPAC digitized pKa"
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        "pka_value": 8.594,
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        "data_source": "IUPAC digitized pKa"
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        "pka_value": 7.948,
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        "data_source": "IUPAC digitized pKa"
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        "pka_value": 7.668,
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        "data_source": "IUPAC digitized pKa"
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        "pka_value": 8.265,
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        "data_source": "IUPAC digitized pKa"
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        "pka_value": 8.33,
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        "data_source": "IUPAC digitized pKa"
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        "pka_value": 8.16,
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        "data_source": "IUPAC digitized pKa"
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        "pka_value": 8.04,
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        "data_source": "IUPAC digitized pKa"
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        "pka_value": 7.92,
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 8.18,
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 8.4,
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 8.84,
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 8.3,
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 8.17,
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 8.12,
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 8.89,
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 8.2,
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 8.23,
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 8.13,
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        "data_source": "IUPAC digitized pKa"
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        "pka_value": 8.46,
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 8.15,
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 8.25,
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 8.21,
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 8.22,
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        "data_source": "IUPAC digitized pKa"
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        "pka_value": 8.09,
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 8.1,
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        "data_source": "IUPAC digitized pKa"
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        "pka_value": 8.71,
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 8.01,
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 7.5,
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 8.64,
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        "data_source": "IUPAC digitized pKa"
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        "pka_value": 8.11,
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        "data_source": "IUPAC digitized pKa"
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        "pka_value": 7.97,
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        "data_source": "IUPAC digitized pKa"
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 8.31,
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        "data_source": "Datawarrior"
      },
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        "data_source": "OCHEM"
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        "data_source": "QSARToolbox"
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        "data_source": "QSARToolbox"
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        "data_source": "QSARToolbox"
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        "data_source": "QSARToolbox"
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        "data_source": "QSARToolbox"
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        "data_source": "QSARToolbox"
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        "data_source": "QSARToolbox"
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        "data_source": "QSARToolbox"
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        "data_source": "QSARToolbox"
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        "data_source": "QSARToolbox"
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        "data_source": "QSARToolbox"
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        "data_source": "QSARToolbox"
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      {
        "pka_value": 8.3100004196167,
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        "data_source": "QSARToolbox"
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        "pka_value": 8.39999961853027,
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        "data_source": "QSARToolbox"
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      {
        "pka_value": 3.1574,
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        "data_source": "IUPAC digitized pKa"
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        "pka_value": 3.1495,
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        "data_source": "IUPAC digitized pKa"
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        "pka_value": 3.1444,
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        "data_source": "IUPAC digitized pKa"
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        "data_source": "IUPAC digitized pKa"
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        "data_source": "IUPAC digitized pKa"
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        "data_source": "IUPAC digitized pKa"
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        "data_source": "IUPAC digitized pKa"
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        "data_source": "IUPAC digitized pKa"
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 3.1599,
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        "data_source": "IUPAC digitized pKa"
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        "data_source": "IUPAC digitized pKa"
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      {
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        "data_source": "IUPAC digitized pKa"
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        "data_source": "IUPAC digitized pKa"
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      {
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        "data_source": "IUPAC digitized pKa"
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        "data_source": "IUPAC digitized pKa"
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      {
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 3.2,
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        "data_source": "IUPAC digitized pKa"
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      {
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        "data_source": "IUPAC digitized pKa"
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        "data_source": "IUPAC digitized pKa"
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      {
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        "data_source": "IUPAC digitized pKa"
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        "data_source": "IUPAC digitized pKa"
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        "data_source": "IUPAC digitized pKa"
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 3.29,
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 3.08,
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 3.15,
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 3.23,
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        "data_source": "IUPAC digitized pKa"
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      {
        "pka_value": 3.15000009536743,
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        "data_source": "QSARToolbox"
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        "data_source": "QSARToolbox"
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        "data_source": "QSARToolbox"
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      {
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        "data_source": "QSARToolbox"
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      {
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        "data_source": "QSARToolbox"
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      {
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        "data_source": "QSARToolbox"
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      {
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        "data_source": "QSARToolbox"
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      {
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        "data_source": "QSARToolbox"
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      {
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        "data_source": "QSARToolbox"
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      {
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        "data_source": "QSARToolbox"
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      {
        "pka_value": 3.14,
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        "data_source": "AttenGpKa training set"
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      {
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        "data_source": "AttenGpKa training set"
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]