EGF-03573 Red

CS(=O)(=O)c1ccc(C(=O)NC(=S)Nc2ccc(F)c(F)c2F)cc1[N+](=O)[O-]
0.376
Platform Score
2D Structure
EGF-03573
C15H10F3N3O5S2 | Exact mass: 433.0014
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
118
TPSA
433
MW
2
HBD
2.5
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 Weight433.40 Da
TPSA118.4 A^2
HBD2
HBA6
SlogP2.54
Fsp30.067
Rotatable Bonds4
Rings2 (2 aromatic)
QED0.329
SA Score2.40 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC15H10F3N3O5S2
Exact Mass433.0014
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.