EGF-05102 Red

COc1ccccc1Oc1nc2cc(C(N)=O)ccc2nc1-c1ccccc1
0.344
Platform Score
2D Structure
EGF-05102
C22H17N3O3 | Exact mass: 371.127
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
87
TPSA
371
MW
1
HBD
4.2
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 Weight371.40 Da
TPSA87.3 A^2
HBD1
HBA5
SlogP4.20
Fsp30.045
Rotatable Bonds5
Rings4 (4 aromatic)
QED0.568
SA Score2.08 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC22H17N3O3
Exact Mass371.127
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes