EGF-02131 Green

CCCNC(=O)c1cccc(NC(=O)C2CCN(c3ccncc3)CC2)c1
0.564
Platform Score
2D Structure
EGF-02131
C21H26N4O2 | Exact mass: 366.2056
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
74
TPSA
366
MW
2
HBD
3.1
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 Weight366.50 Da
TPSA74.3 A^2
HBD2
HBA4
SlogP3.08
Fsp30.381
Rotatable Bonds6
Rings3 (2 aromatic)
QED0.824
SA Score1.97 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC21H26N4O2
Exact Mass366.2056
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes