ARION
AI Drug Discovery Platform
BBB Predictor
Chemical Space
BBB Optimizer
Benchmarks
New Project
Dashboard
Dashboard
PLK4
Compounds
Compounds
(2 results)
Scaffold: C1CC(CC2CCC(CC3CCC(C4CC4)C(CC4...
×
All
Green
Yellow
Leads
Scaffolds
SAR Heatmap
Matched Pairs
CSV
SDF
Sort: Platform Rank
Sort: RP-1664 Similarity
Sort: Docking Score
Sort: Platform Score
Sort: BBB Probability
Sort: 3D PSA (lowest)
Sort: MDCK Perm (best)
Sort: MW
Rank
ID
Structure
Score
1664 Sim
Traffic
BBB
Vina
3D PSA
MDCK
TPSA
MW
HBD
SlogP
SA
1025
BBP-28614
LEAD
0.497
0.435
Green
0.68
-
63
-4.7
73
425
2
4.4
3.1
3060
BBP-28454
0.371
0.470
Red
0.62
-
38
-4.7
73
425
2
4.4
3.0
Compare Selected (
0
)