EGF-02091 Green

O=S(=O)(c1ccccc1F)N1CCN(c2ccc(F)cc2)CC1
0.591
Platform Score
2D Structure
EGF-02091
C16H16F2N2O2S | Exact mass: 338.0901
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
41
TPSA
338
MW
0
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 Weight338.40 Da
TPSA40.6 A^2
HBD0
HBA3
SlogP2.48
Fsp30.250
Rotatable Bonds3
Rings3 (2 aromatic)
QED0.863
SA Score1.80 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC16H16F2N2O2S
Exact Mass338.0901
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes