SynthArenav0.4.0
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  5. Syntheseus LocalRetro on ref-cnv-400
Target 1 of 400

Syntheseus LocalRetroonref-cnv-400

Part of the Syntheseus algorithm family
Verified
2,670
Routes Found
104.3 min
Total Duration
$0.31
Cost
Dec 3, 2025
Executed
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
74.8%6.0%8.0%8.8%10.8%11.3%13.3%13.3%13.3%13.3%13.3%13.3%13.3%

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
284.0%15.0%20.0%22.0%27.0%27.0%28.0%28.0%28.0%28.0%28.0%28.0%28.0%100
384.0%7.0%8.0%8.0%11.0%12.0%14.0%14.0%14.0%14.0%14.0%14.0%14.0%100
465.0%1.0%2.0%2.0%2.0%2.0%6.0%6.0%6.0%6.0%6.0%6.0%6.0%100
566.0%1.0%2.0%3.0%3.0%4.0%5.0%5.0%5.0%5.0%5.0%5.0%5.0%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 6 • Length: 3 steps • Convergent
View:
Stock-Terminated
/ 10
Acceptable Route 1
Not in Stock
Not in Stock
In Stock
Not in Stock
Not in Stock
In Stock
In Stock
Not in Stock
In Stock
Not in Stock
Not in Stock
In Stock
In Stock
In Stock
React Flow
Press enter or space to select a node. You can then use the arrow keys to move the node around. Press delete to remove it and escape to cancel.
Press enter or space to select an edge. You can then press delete to remove it or escape to cancel.
Prediction
Not in Stock
Not in Stock
In Stock
In Stock
Not in Stock
Not in Stock
In Stock
In Stock
In Stock
React Flow
Press enter or space to select a node. You can then use the arrow keys to move the node around. Press delete to remove it and escape to cancel.
Press enter or space to select an edge. You can then press delete to remove it or escape to cancel.
Legend:
Match
Extension