EGF-06162 Red

CSc1nc(-c2cc[nH]c(=NC(=O)c3ccccc3)c2)c(-c2cccc(C(F)(F)F)c2)[nH]1
0.264
Platform Score
2D Structure
EGF-06162
C23H17F3N4OS | Exact mass: 454.1075
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
74
TPSA
454
MW
2
HBD
5.5
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 Weight454.50 Da
TPSA73.9 A^2
HBD2
HBA3
SlogP5.55
Fsp30.087
Rotatable Bonds4
Rings4 (4 aromatic)
QED0.397
SA Score2.95 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC23H17F3N4OS
Exact Mass454.1075
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes