EGF-01670 Green

NCCC(=O)N1CCN(c2cccc(Cl)c2Cl)CC1
0.593
Platform Score
2D Structure
EGF-01670
C13H17Cl2N3O | Exact mass: 301.0749
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
50
TPSA
302
MW
1
HBD
2.0
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 Weight302.20 Da
TPSA49.6 A^2
HBD1
HBA3
SlogP1.99
Fsp30.462
Rotatable Bonds3
Rings2 (1 aromatic)
QED0.929
SA Score2.02 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC13H17Cl2N3O
Exact Mass301.0749
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes