EGF-00342 Green

Fc1cccc(COc2ncc(N3CCNCC3)cc2Cl)c1
0.699
Platform Score
2D Structure
EGF-00342
C16H17ClFN3O | Exact mass: 321.1044
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
37
TPSA
322
MW
1
HBD
2.9
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 Weight321.80 Da
TPSA37.4 A^2
HBD1
HBA4
SlogP2.86
Fsp30.312
Rotatable Bonds4
Rings3 (2 aromatic)
QED0.939
SA Score2.26 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC16H17ClFN3O
Exact Mass321.1044
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes