EGF-02613 Yellow

COCCCN1CCn2nc(COc3ccccc3C)cc2C1=O
0.519
Platform Score
2D Structure
EGF-02613
C18H23N3O3 | Exact mass: 329.1739
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
57
TPSA
329
MW
0
HBD
2.3
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 Weight329.40 Da
TPSA56.6 A^2
HBD0
HBA5
SlogP2.26
Fsp30.444
Rotatable Bonds7
Rings3 (2 aromatic)
QED0.731
SA Score2.40 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC18H23N3O3
Exact Mass329.1739
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes