ARION
AI Drug Discovery Platform
BBB Predictor
Chemical Space
BBB Optimizer
Benchmarks
New Project
Dashboard
Dashboard
PLK4
Compounds
Compounds
(3 results)
Scaffold: C1CCCC(C2CC(CC3CCCC3)CC(C3CCCC...
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Leads
Scaffolds
SAR Heatmap
Matched Pairs
CSV
SDF
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Sort: MW
Rank
ID
Structure
Score
1664 Sim
Traffic
BBB
Vina
3D PSA
MDCK
TPSA
MW
HBD
SlogP
SA
13
BBP-22105
0.597
0.348
Green
0.72
-10.8
56
-4.7
83
399
2
3.8
3.4
22
BBP-19512
0.584
0.326
Green
0.72
-10.3
58
-4.7
83
381
2
3.7
3.3
528
BBP-19257
0.522
0.333
Red
0.75
-10.6
32
-4.7
70
398
2
4.4
3.2
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