EGF-06107 Red
N#Cc1nc(Cl)c(F)c(N2N=C(C(F)(F)F)CC2c2ccc(Cl)cc2)n1
0.305
Platform Score
2D Structure
C15H7Cl2F4N5 | Exact mass: 403.0015
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
65
TPSA
404
MW
0
HBD
4.7
SlogP
Display Controls
EGFR Docking Result
N/A
kcal/mol (molecular docking)
| Docking Rank | #- of 1,249 |
| Consensus Score | - |
| Receptor | EGFR (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 Weight | 404.20 Da |
| TPSA | 65.2 A^2 |
| HBD | 0 |
| HBA | 5 |
| SlogP | 4.66 |
| Fsp3 | 0.200 |
| Rotatable Bonds | 2 |
| Rings | 3 (2 aromatic) |
| QED | 0.540 |
| SA Score | 3.60 (1=easy, 10=hard) |
| CNS MPO | - / 4.0 |
| Formula | C15H7Cl2F4N5 |
| Exact Mass | 403.0015 |
Classification
| Scaffold (Murcko) | - |
| Source Versions | - |
| Best Source Score | - |
| Best Source Rank | #- |
| Hinge Binder | Not present |
| InChIKey | - |
| Filter Pass | Yes |