EGF-04966 Red

COc1ccccc1NCC(O)C(Cc1ccccc1)NC(=O)CCNC(=O)c1cc(C)ccc1N
0.258
Platform Score
2D Structure
EGF-04966
C28H34N4O4 | Exact mass: 490.258
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
126
TPSA
491
MW
5
HBD
2.9
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 Weight490.60 Da
TPSA125.7 A^2
HBD5
HBA6
SlogP2.91
Fsp30.286
Rotatable Bonds12
Rings3 (3 aromatic)
QED0.249
SA Score3.00 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC28H34N4O4
Exact Mass490.258
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes