EGF-01120 Green

CC1Sc2ccc(S(=O)(=O)N3CCN(Cc4ccccc4)C(C)C3)cc2NC1=O
0.571
Platform Score
2D Structure
EGF-01120
C21H25N3O3S2 | Exact mass: 431.1337
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
70
TPSA
432
MW
1
HBD
3.0
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 Weight431.60 Da
TPSA69.7 A^2
HBD1
HBA5
SlogP3.01
Fsp30.381
Rotatable Bonds4
Rings4 (2 aromatic)
QED0.806
SA Score3.15 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC21H25N3O3S2
Exact Mass431.1337
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes