EGF-00151 Green

O=S(=O)(NCCN1CCOCC1)c1cc(Cl)ccc1Cl
0.686
Platform Score
2D Structure
EGF-00151
C12H16Cl2N2O3S | Exact mass: 338.0259
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
59
TPSA
339
MW
1
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 Weight339.20 Da
TPSA58.6 A^2
HBD1
HBA4
SlogP1.60
Fsp30.500
Rotatable Bonds5
Rings2 (1 aromatic)
QED0.885
SA Score2.03 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC12H16Cl2N2O3S
Exact Mass338.0259
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes