EGF-05794 Red

Fc1ccc(-c2nc(C3CCOC3)[nH]c2-c2cc[nH]c(=Nc3cc(N4CCNCC4)ccn3)n2)cc1
0.302
Platform Score
2D Structure
EGF-05794
C26H27FN8O | Exact mass: 486.2292
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
1
Hinge Binder
107
TPSA
487
MW
3
HBD
3.1
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 Weight486.60 Da
TPSA107.1 A^2
HBD3
HBA7
SlogP3.15
Fsp30.308
Rotatable Bonds5
Rings6 (4 aromatic)
QED0.400
SA Score3.82 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC26H27FN8O
Exact Mass486.2292
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder 4-Aminoquinazoline Hinge
InChIKey-
Filter PassYes