EGF-07098 Red

O=C(Cn1ccc2nnnn2c1=O)NC1CCN(Cc2ccc3ccc(F)cc3c2)CC1
0.299
Platform Score
2D Structure
EGF-07098
C22H22FN7O2 | Exact mass: 435.1819
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
97
TPSA
436
MW
1
HBD
1.4
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 Weight435.50 Da
TPSA97.4 A^2
HBD1
HBA8
SlogP1.36
Fsp30.318
Rotatable Bonds5
Rings5 (4 aromatic)
QED0.508
SA Score2.66 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC22H22FN7O2
Exact Mass435.1819
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes