EGF-00320 Green

N=c1[nH]c(Nc2cccc(Cl)c2)cc(Cl)c1NC(=O)c1ccccc1F
0.554
Platform Score
2D Structure
EGF-00320
C18H13Cl2FN4O | Exact mass: 390.045
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
1
Hinge Binder
81
TPSA
391
MW
4
HBD
4.9
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 Weight391.20 Da
TPSA80.8 A^2
HBD4
HBA3
SlogP4.94
Fsp3-
Rotatable Bonds4
Rings3 (3 aromatic)
QED0.509
SA Score2.60 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC18H13Cl2FN4O
Exact Mass390.045
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder 4-Aminoquinazoline Hinge
InChIKey-
Filter PassYes