DMS Explorer XL on mkt-cnv-160 | SynthArena by isChemist Group

DMS Explorer XL

Benchmark

Total Routes

4226

Executed

December 1st, 2025

Duration

47.6 min

Total Cost

$1.02

Acceptable Routes

Available

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
96.3%	33.8%	46.3%	48.8%	55.6%	55.6%	57.5%	58.8%	59.4%	59.4%	59.4%	59.4%	59.4%

n = 160 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	100.0%	50.0%	62.5%	67.5%	72.5%	72.5%	75.0%	77.5%	80.0%	80.0%	80.0%	80.0%	80.0%	40
3	100.0%	30.0%	45.0%	45.0%	52.5%	52.5%	57.5%	60.0%	60.0%	60.0%	60.0%	60.0%	60.0%	40
4	92.5%	15.0%	30.0%	32.5%	45.0%	45.0%	45.0%	45.0%	45.0%	45.0%	45.0%	45.0%	45.0%	40
5	92.5%	40.0%	47.5%	50.0%	52.5%	52.5%	52.5%	52.5%	52.5%	52.5%	52.5%	52.5%	52.5%	40

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

Target 1 of 160

n5-00045

4 stepsConvergentHas Acceptable Routes

SMILES

OC(COc1cccc(-c2ccc3ncn(Cc4ccccc4)c3c2)c1)CN1CCc2ccccc2C1

InChiKey

QRPLRPXUJNDKKA-UHFFFAOYSA-N

Prediction Route

Rank 1 • Length: 4 steps • Convergent

Unsolved

Solvability evaluated against: ASKCOS Buyables Stock

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Acceptable Route

Single route available

Prediction Rank

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Rank:

Rank 1 of 18

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Hash: f2c5ce210984988d760e5bb4ace65f64836ad19194938e2d65c73bb9a2c0a616