EGF-06112 Red

COc1ccccc1C=CC=NNC(=O)c1ccccc1Nc1cccc(C)c1C
0.293
Platform Score
2D Structure
EGF-06112
C25H25N3O2 | Exact mass: 399.1947
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
63
TPSA
400
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 Weight399.50 Da
TPSA62.7 A^2
HBD2
HBA4
SlogP5.48
Fsp30.120
Rotatable Bonds7
Rings3 (3 aromatic)
QED0.408
SA Score2.28 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC25H25N3O2
Exact Mass399.1947
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes