ARION
AI Drug Discovery Platform
BBB Predictor
Chemical Space
BBB Optimizer
Benchmarks
New Project
Dashboard
Dashboard
PLK4
Compounds
Compounds
(3 results)
Scaffold: C1CCC(CC2CC(CC3CCCC3)CCC2C2CC2...
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Leads
Scaffolds
SAR Heatmap
Matched Pairs
CSV
SDF
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Sort: BBB Probability
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Sort: MW
Rank
ID
Structure
Score
1664 Sim
Traffic
BBB
Vina
3D PSA
MDCK
TPSA
MW
HBD
SlogP
SA
1272
BBP-28817
0.483
0.423
Green
0.56
-
39
-4.7
70
370
2
4.5
3.1
1318
BBP-29106
0.480
0.407
Green
0.57
-
66
-4.7
79
386
2
4.2
3.1
1332
BBP-28647
0.480
0.402
Green
0.53
-
65
-4.7
79
386
2
4.2
3.0
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