ARION
AI Drug Discovery Platform
BBB Predictor
Chemical Space
BBB Optimizer
Benchmarks
New Project
Dashboard
Dashboard
PLK4
Compounds
Compounds
(3 results)
Scaffold: C1CC(CC2CCCC(C3CC3)C2)CC(CC2CC...
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Leads
Scaffolds
SAR Heatmap
Matched Pairs
CSV
SDF
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Sort: RP-1664 Similarity
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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
1236
BBP-23234
0.486
0.291
Green
0.63
-
47
-4.7
74
393
1
4.3
3.4
1661
BBP-19679
0.464
0.314
Yellow
0.59
-7.0
59
-4.7
83
361
2
4.2
3.0
2254
BBP-22181
0.434
0.369
Yellow
0.65
-
57
-4.7
83
379
2
4.3
3.2
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