EGF-06982 Red

O=C(CC1CCC2C(COCC(O)CN2C(=O)Nc2cccc(F)c2F)O1)NCc1cccnc1
0.297
Platform Score
2D Structure
EGF-06982
C24H28F2N4O5 | Exact mass: 490.2028
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
113
TPSA
490
MW
3
HBD
2.2
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 Weight490.50 Da
TPSA113.0 A^2
HBD3
HBA6
SlogP2.21
Fsp30.458
Rotatable Bonds5
Rings4 (2 aromatic)
QED0.593
SA Score3.83 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC24H28F2N4O5
Exact Mass490.2028
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes