EGF-06416 Red

O=C(Nc1c(O)cccc1Br)c1cc2ccccc2oc1=O
0.359
Platform Score
2D Structure
EGF-06416
C16H10BrNO4 | Exact mass: 358.9793
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
80
TPSA
360
MW
2
HBD
3.5
SlogP
Display Controls
Rotate: drag | Zoom: scroll | Pan: right-drag | Double-click: center Loading...
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 Weight360.20 Da
TPSA79.5 A^2
HBD2
HBA4
SlogP3.51
Fsp3-
Rotatable Bonds2
Rings3 (3 aromatic)
QED0.541
SA Score2.17 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC16H10BrNO4
Exact Mass358.9793
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes