EGF-02981 Yellow

Cc1cc(C)c2c(n1)N(Cc1ccc(C(=O)N(C)C)cc1)CC(C)C(=O)N2CCN(C)C
0.521
Platform Score
2D Structure
EGF-02981
C25H35N5O2 | Exact mass: 437.2791
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
1
Hinge Binder
60
TPSA
438
MW
0
HBD
3.0
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 Weight437.60 Da
TPSA60.0 A^2
HBD0
HBA5
SlogP2.95
Fsp30.480
Rotatable Bonds6
Rings3 (2 aromatic)
QED0.695
SA Score3.15 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC25H35N5O2
Exact Mass437.2791
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder 4-Aminoquinazoline Hinge
InChIKey-
Filter PassYes