EGF-01627 Green

Cc1ccc(N)[nH]c1=NC(=O)Nc1ccc(Cl)cc1Cl
0.553
Platform Score
2D Structure
EGF-01627
C13H12Cl2N4O | Exact mass: 310.0388
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
1
Hinge Binder
83
TPSA
311
MW
3
HBD
3.3
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 Weight311.20 Da
TPSA83.3 A^2
HBD3
HBA2
SlogP3.34
Fsp30.077
Rotatable Bonds1
Rings2 (2 aromatic)
QED0.754
SA Score2.87 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC13H12Cl2N4O
Exact Mass310.0388
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder 4-Aminoquinazoline Hinge
InChIKey-
Filter PassYes