EGF-03674 Red

CCOC(=O)NC(CSCCCNC(=O)CCN)C(=O)N1CCN(c2ccc(F)cc2)CC1
0.338
Platform Score
2D Structure
EGF-03674
C22H34FN5O4S | Exact mass: 483.2316
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
117
TPSA
484
MW
3
HBD
1.2
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 Weight483.60 Da
TPSA117.0 A^2
HBD3
HBA7
SlogP1.18
Fsp30.591
Rotatable Bonds12
Rings2 (1 aromatic)
QED0.382
SA Score2.91 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC22H34FN5O4S
Exact Mass483.2316
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes