EGF-00822 Green

CC(=O)N(CCNc1ccccc1)c1ccc(Cl)cc1Cl
0.620
Platform Score
2D Structure
EGF-00822
C16H16Cl2N2O | Exact mass: 322.064
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
32
TPSA
323
MW
1
HBD
4.5
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 Weight323.20 Da
TPSA32.3 A^2
HBD1
HBA2
SlogP4.46
Fsp30.188
Rotatable Bonds5
Rings2 (2 aromatic)
QED0.881
SA Score2.04 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC16H16Cl2N2O
Exact Mass322.064
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes