EGF-04902 Red

CC1C=C2CC(c3ccccc3)OC(=O)C2C(OC(=O)c2ccccn2)C1
0.330
Platform Score
2D Structure
EGF-04902
C22H21NO4 | Exact mass: 363.1471
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
66
TPSA
363
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 Weight363.40 Da
TPSA65.5 A^2
HBD0
HBA5
SlogP3.88
Fsp30.318
Rotatable Bonds3
Rings4 (2 aromatic)
QED0.612
SA Score3.93 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC22H21NO4
Exact Mass363.1471
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes