EGF-01718 Yellow

O=C(c1cc(S(=O)(=O)N2CCOCC2)ccc1F)N1CCN(C2CCCC2)CC1
0.520
Platform Score
2D Structure
EGF-01718
C20H28FN3O4S | Exact mass: 425.1785
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
70
TPSA
426
MW
0
HBD
1.6
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 Weight425.50 Da
TPSA70.2 A^2
HBD0
HBA5
SlogP1.55
Fsp30.650
Rotatable Bonds4
Rings4 (1 aromatic)
QED0.732
SA Score2.25 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC20H28FN3O4S
Exact Mass425.1785
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes