EGF-06310 Red

CC(Sc1nnc(COCc2ccccc2)o1)C(=O)N1CCc2ccccc21
0.349
Platform Score
2D Structure
EGF-06310
C21H21N3O3S | Exact mass: 395.1304
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
68
TPSA
396
MW
0
HBD
3.9
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 Weight395.50 Da
TPSA68.5 A^2
HBD0
HBA6
SlogP3.86
Fsp30.286
Rotatable Bonds7
Rings4 (3 aromatic)
QED0.566
SA Score2.76 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC21H21N3O3S
Exact Mass395.1304
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes