EGF-02332 Green

CC(C)N1CCN(C(=O)c2cccc(Cl)c2Cl)CC1=O
0.574
Platform Score
2D Structure
EGF-02332
C14H16Cl2N2O2 | Exact mass: 314.0589
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
41
TPSA
315
MW
0
HBD
2.7
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 Weight315.20 Da
TPSA40.6 A^2
HBD0
HBA2
SlogP2.69
Fsp30.429
Rotatable Bonds2
Rings2 (1 aromatic)
QED0.842
SA Score2.25 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC14H16Cl2N2O2
Exact Mass314.0589
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes