EGF-02747 Yellow

O=C(c1ccc(N2CCCC2)c(NS(=O)(=O)c2ccc(Cl)cc2)c1)N1CCCC1
0.518
Platform Score
2D Structure
EGF-02747
C21H24ClN3O3S | Exact mass: 433.1227
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
70
TPSA
434
MW
1
HBD
4.0
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 Weight434.00 Da
TPSA69.7 A^2
HBD1
HBA4
SlogP3.98
Fsp30.381
Rotatable Bonds5
Rings4 (2 aromatic)
QED0.774
SA Score2.02 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC21H24ClN3O3S
Exact Mass433.1227
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes