EGF-01855 Green

CNC(=O)c1cnc(N2CCN(c3cccc(Cl)c3)CC2)c(F)c1
0.622
Platform Score
2D Structure
EGF-01855
C17H18ClFN4O | Exact mass: 348.1153
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
1
Hinge Binder
48
TPSA
349
MW
1
HBD
2.6
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 Weight348.80 Da
TPSA48.5 A^2
HBD1
HBA4
SlogP2.56
Fsp30.294
Rotatable Bonds3
Rings3 (2 aromatic)
QED0.926
SA Score2.12 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC17H18ClFN4O
Exact Mass348.1153
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder 4-Aminoquinazoline Hinge
InChIKey-
Filter PassYes