EGF-04962 Red

CC(=O)Nc1ccc(S(=O)(=O)Nc2cccc(C(=O)c3ccccc3)c2Cl)cc1
0.341
Platform Score
2D Structure
EGF-04962
C21H17ClN2O4S | Exact mass: 428.0598
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
92
TPSA
429
MW
2
HBD
4.3
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 Weight428.90 Da
TPSA92.3 A^2
HBD2
HBA4
SlogP4.33
Fsp30.048
Rotatable Bonds6
Rings3 (3 aromatic)
QED0.571
SA Score1.97 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC21H17ClN2O4S
Exact Mass428.0598
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes