SynthArenav0.3.0
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  5. AiZynthFinder Retro* on ref-cnv-400
AiZynthFinder Retro*
Benchmark
ref-cnv-400
Total Routes
5605
Executed
December 2nd, 2025
Duration
319.2 min
Total Cost
$0.95
Acceptable Routes
Available
Target 1 of 400
Overall Metrics
Performance metrics across all targets in the benchmark. Hover over values to see 95% confidence intervals.
SolvabilityTop-1Top-2Top-3Top-4Top-5Top-10Top-20Top-50Top-100Top-500Top-1000Top-10000
87.5%8.0%12.0%14.0%14.8%16.3%21.0%23.3%24.0%24.0%24.0%24.0%24.0%

n = 400 targets

Metrics by Route Length
Performance breakdown by acceptable route length.
LengthSolvabilityTop-1Top-2Top-3Top-4Top-5Top-10Top-20Top-50Top-100Top-500Top-1000Top-10000n
297.0%21.0%28.0%33.0%34.0%37.0%44.0%47.0%48.0%48.0%48.0%48.0%48.0%100
390.0%5.0%7.0%8.0%9.0%11.0%17.0%19.0%19.0%19.0%19.0%19.0%19.0%100
483.0%5.0%9.0%10.0%10.0%11.0%15.0%17.0%19.0%19.0%19.0%19.0%19.0%100
580.0%1.0%4.0%5.0%6.0%6.0%8.0%10.0%10.0%10.0%10.0%10.0%10.0%100

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

n5-00045

4 stepsConvergentHas Acceptable Routes

SMILES

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

InChiKey

QRPLRPXUJNDKKA-UHFFFAOYSA-N

Prediction Route
Rank 1 • Length: 3 steps • Convergent
Solved
Solvability evaluated against: n5 Stock
View:
Single route available
Navigate through predictions
Rank:
Rank 1 of 25
React Flow
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Hash: b8c89272390c9e873e87c4e166765789597d3b379f81e4f6330c91e956fc96c6