EGF-04906 Red

CCn1c2c(c3ccc(OCCCN4CCCCC4)cc31)CN(Cc1ccccc1)CC2
0.328
Platform Score
2D Structure
EGF-04906
C28H37N3O | Exact mass: 431.2937
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
21
TPSA
432
MW
0
HBD
5.5
SlogP
Display Controls
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EGFR Docking Result
N/A
kcal/mol (molecular docking)
Docking Rank#- of 1,249
Consensus Score-
ReceptorEGFR (PDB: 1M17)
Selective No
Selectivity Profile
ADMET Profile
BBB (BOILED-Egg) BBB- (non-penetrant)
ADMET Status Pass (no hard fails)
CNS Drug-Likeness
Physicochemical Properties
Molecular Weight431.60 Da
TPSA20.6 A^2
HBD0
HBA4
SlogP5.47
Fsp30.500
Rotatable Bonds8
Rings5 (3 aromatic)
QED0.441
SA Score2.34 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC28H37N3O
Exact Mass431.2937
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes