EGF-01697 Green

Cc1ccc(-n2nccn2)c(C(=O)N(C)C2CCN(c3ccccn3)CC2)c1
0.560
Platform Score
2D Structure
EGF-01697
C21H24N6O | Exact mass: 376.2012
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
1
Hinge Binder
67
TPSA
376
MW
0
HBD
2.7
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 Weight376.50 Da
TPSA67.2 A^2
HBD0
HBA6
SlogP2.71
Fsp30.333
Rotatable Bonds4
Rings4 (3 aromatic)
QED0.700
SA Score2.55 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC21H24N6O
Exact Mass376.2012
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder 4-Aminoquinazoline Hinge
InChIKey-
Filter PassYes