EGF-02789 Green

O=C(c1ccccc1Cl)N1CCC(C(=O)N2CCCC2)CC1
0.577
Platform Score
2D Structure
EGF-02789
C17H21ClN2O2 | Exact mass: 320.1292
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
41
TPSA
321
MW
0
HBD
2.8
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 Weight320.80 Da
TPSA40.6 A^2
HBD0
HBA2
SlogP2.81
Fsp30.529
Rotatable Bonds2
Rings3 (1 aromatic)
QED0.840
SA Score1.78 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC17H21ClN2O2
Exact Mass320.1292
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes