EGF-03066 Green

O=C(c1cccc(N2CCCCC2)n1)N1CCC(Oc2ccccc2)CC1
0.564
Platform Score
2D Structure
EGF-03066
C22H27N3O2 | Exact mass: 365.2103
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
1
Hinge Binder
46
TPSA
366
MW
0
HBD
3.8
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 Weight365.50 Da
TPSA45.7 A^2
HBD0
HBA4
SlogP3.76
Fsp30.455
Rotatable Bonds4
Rings4 (2 aromatic)
QED0.828
SA Score2.11 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC22H27N3O2
Exact Mass365.2103
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder 4-Aminoquinazoline Hinge
InChIKey-
Filter PassYes