DILI / LD50 Zhu
Drug-induced liver injury + rat LD50 (Zhu) — standard acute tox benchmarks.
Composite score: 73.9
Rubric (1–5 per criterion)
rigor
4/5
coverage
2/5
maintenance
4/5
adoption
4/5
quality
3/5
accessibility
5/5
industry_relevance
4/5
Metadata
Stages
IND-enablingLead ID / ADMET
Modalities
small-molecule
Task types
toxicity-regression
License
MIT
First release
2021-02
Last updated
2024-12
Flags
none
Size & scope
- dili_molecules: 475
- ld50_molecules: 7385
Primary paper
Title
Quantitative structure-activity relationship modeling of rat acute toxicity
Authors
Zhu H, Martin TM, Ye L, et al.
Year
2009
DOI / arXiv
Citations
460
Links
- Official site: https://tdcommons.ai/single_pred_tasks/tox/#dili
- GitHub: https://github.com/mims-harvard/TDC
- Leaderboard: https://tdcommons.ai/benchmark/admet_group/
Hosted by (initiatives)
Experts (primary authors / maintainers)
Groups (host labs / companies / consortia)
Related benchmarks
Notes (honest caveats)
Essential IND-enabling endpoints.