EGF-01105 Green

CN1CCN(c2nc(N3CCOCC3)nc3ccc(Cl)cc23)CC1
0.588
Platform Score
2D Structure
EGF-01105
C17H22ClN5O | Exact mass: 347.1513
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
45
TPSA
348
MW
0
HBD
1.9
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 Weight347.90 Da
TPSA44.7 A^2
HBD0
HBA6
SlogP1.87
Fsp30.529
Rotatable Bonds2
Rings4 (2 aromatic)
QED0.826
SA Score2.23 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC17H22ClN5O
Exact Mass347.1513
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes