Syntheseus LocalRetro on ref-lin-600 | SynthArena by isChemist Group

Syntheseus LocalRetroonref-lin-600

Part of the Syntheseus algorithm family

Verified

Overall Metrics

Performance metrics across all targets in the benchmark. Hover over values to see 95% confidence intervals.

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
67.2%	5.0%	6.7%	8.5%	10.2%	10.8%	13.0%	13.0%	13.0%	13.0%	13.0%	13.0%	13.0%

n = 600 targets

Metrics by Route Length

Performance breakdown by acceptable route length.

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	79.0%	17.0%	21.0%	22.0%	24.0%	25.0%	29.0%	29.0%	29.0%	29.0%	29.0%	29.0%	29.0%	100
3	69.0%	8.0%	10.0%	15.0%	18.0%	18.0%	22.0%	22.0%	22.0%	22.0%	22.0%	22.0%	22.0%	100
4	73.0%	3.0%	6.0%	8.0%	11.0%	12.0%	13.0%	13.0%	13.0%	13.0%	13.0%	13.0%	13.0%	100
5	72.0%	2.0%	2.0%	4.0%	5.0%	5.0%	7.0%	7.0%	7.0%	7.0%	7.0%	7.0%	7.0%	100
6	62.0%	0.0%	1.0%	2.0%	3.0%	4.0%	6.0%	6.0%	6.0%	6.0%	6.0%	6.0%	6.0%	100
7	48.0%	0.0%	0.0%	0.0%	0.0%	1.0%	1.0%	1.0%	1.0%	1.0%	1.0%	1.0%	1.0%	100

Confidence intervals available on hover. Reliability indicators show LOW_N (insufficient samples) or EXTREME_P (value near boundary).

Target 1 of 600

Only with predictions

n5-00015

7 stepsLinearHas Acceptable Routes

SMILES

c1ccc(-c2cc3cc(-c4ccncn4)c(-c4ccco4)nc3[nH]2)cc1

InChiKey

GMOSJDXQORTJOO-UHFFFAOYSA-N

No predictions found for this target. The model did not generate any routes.