EGF-02404 Red

Cc1c(C(=O)NN=Cc2ccc(Br)o2)nnn1-c1nn(C)c(=O)n1-c1ccc(Cl)cc1
0.379
Platform Score
2D Structure
EGF-02404
C18H14BrClN8O3 | Exact mass: 504.0061
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
125
TPSA
506
MW
1
HBD
2.2
SlogP
Display Controls
Rotate: drag | Zoom: scroll | Pan: right-drag | Double-click: center Loading...
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 Weight505.70 Da
TPSA125.1 A^2
HBD1
HBA10
SlogP2.23
Fsp30.111
Rotatable Bonds5
Rings4 (4 aromatic)
QED0.327
SA Score2.98 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC18H14BrClN8O3
Exact Mass504.0061
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.