EGF-06033 Red

CCC(NC)C(=O)NC1=NC(C)(c2cc(F)ccc2F)CN(C)C1
0.384
Platform Score
2D Structure
EGF-06033
C17H24F2N4O | Exact mass: 338.1918
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
57
TPSA
338
MW
2
HBD
1.6
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 Weight338.40 Da
TPSA56.7 A^2
HBD2
HBA4
SlogP1.64
Fsp30.529
Rotatable Bonds4
Rings2 (1 aromatic)
QED0.877
SA Score3.69 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC17H24F2N4O
Exact Mass338.1918
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.