EGF-02923 Yellow

COC1CCN(C(=O)c2cc(F)cc(C(F)(F)F)c2)C2CN(C(=O)N(C)C)CCC12
0.486
Platform Score
2D Structure
EGF-02923
C20H25F4N3O3 | Exact mass: 431.1832
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
53
TPSA
431
MW
0
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 Weight431.40 Da
TPSA53.1 A^2
HBD0
HBA3
SlogP3.08
Fsp30.600
Rotatable Bonds2
Rings3 (1 aromatic)
QED0.677
SA Score3.71 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC20H25F4N3O3
Exact Mass431.1832
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes
Retrosynthetic Analysis

Retrosynthetic analysis not yet run for this compound.

About

Retrosynthetic analysis decomposes the target molecule into purchasable building blocks using learned reaction templates.

A feasible route means the molecule can theoretically be synthesized from commercially available starting materials.

Min steps indicates the shortest synthesis route found.