EGF-05240 Red

COCCC1CCCN1S(=O)(=O)c1ccc2c(c1)N(Cc1nc(-c3ccc(Cl)cc3Cl)co1)CC2
0.256
Platform Score
2D Structure
EGF-05240
C25H27Cl2N3O4S | Exact mass: 535.1099
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
76
TPSA
536
MW
0
HBD
5.4
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 Weight536.50 Da
TPSA75.9 A^2
HBD0
HBA6
SlogP5.40
Fsp30.400
Rotatable Bonds8
Rings5 (3 aromatic)
QED0.384
SA Score3.26 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC25H27Cl2N3O4S
Exact Mass535.1099
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes