| Solvability | Top-1 | Top-2 | Top-3 | Top-4 | Top-5 | Top-10 | Top-20 | Top-50 | Top-100 | Top-500 | Top-1000 | Top-10000 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 98.1% | 21.3% | 30.0% | 32.5% | 36.3% | 38.1% | 41.3% | 42.5% | 42.5% | 42.5% | 42.5% | 42.5% | 42.5% |
n = 160 targets
| Length | Solvability | Top-1 | Top-2 | Top-3 | Top-4 | Top-5 | Top-10 | Top-20 | Top-50 | Top-100 | Top-500 | Top-1000 | Top-10000 | n |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 2 | 100.0% | 45.0% | 67.5% | 70.0% | 70.0% | 72.5% | 75.0% | 77.5% | 77.5% | 77.5% | 77.5% | 77.5% | 77.5% | 40 |
| 3 | 100.0% | 20.0% | 22.5% | 27.5% | 37.5% | 40.0% | 50.0% | 50.0% | 50.0% | 50.0% | 50.0% | 50.0% | 50.0% | 40 |
| 4 | 92.5% | 10.0% | 20.0% | 22.5% | 22.5% | 25.0% | 25.0% | 25.0% | 25.0% | 25.0% | 25.0% | 25.0% | 25.0% | 40 |
| 5 | 100.0% | 10.0% | 10.0% | 10.0% | 15.0% | 15.0% | 15.0% | 17.5% | 17.5% | 17.5% | 17.5% | 17.5% | 17.5% | 40 |
Confidence intervals available on hover. Reliability indicators show LOW_N (insufficient samples) or EXTREME_P (value near boundary).
SMILES
OC(COc1cccc(-c2ccc3ncn(Cc4ccccc4)c3c2)c1)CN1CCc2ccccc2C1
InChiKey
QRPLRPXUJNDKKA-UHFFFAOYSA-N