EGF-05779 Red

CC(C)(C)n1nnnc1C(c1ccc(F)cc1)N1CCC2(CC1)C(=O)NCN2c1ccccc1
0.353
Platform Score
2D Structure
EGF-05779
C25H30FN7O | Exact mass: 463.2496
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
79
TPSA
464
MW
1
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 Weight463.60 Da
TPSA79.2 A^2
HBD1
HBA7
SlogP3.09
Fsp30.440
Rotatable Bonds4
Rings5 (3 aromatic)
QED0.641
SA Score3.66 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC25H30FN7O
Exact Mass463.2496
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes