{
  "domain": "life-health",
  "topics": [
    "drug-discovery"
  ],
  "type": "algorithm",
  "benchmark": {
    "task": "Predict aqueous solubility (log mol/L) from a SMILES string",
    "metric": {
      "name": "MAE (log mol/L)",
      "better": "lower"
    },
    "baseline": {
      "name": "Top of the TDC leaderboard (MiniMol)",
      "score": 0.741
    }
  },
  "source": {
    "key": "tdc-admet",
    "name": "Therapeutics Data Commons ADMET benchmark group",
    "url": "https://tdcommons.ai/benchmark/admet_group/06aqsol/",
    "id": "Solubility_AqSolDB",
    "curator": "Therapeutics Data Commons (Harvard)",
    "poser": "Sorkun et al.",
    "status": "open",
    "as_of": "2026-10-20",
    "catalog": "0521c19bbd38"
  }
}