EGF-01361 Green

Clc1cccc(N2CCN(Cc3nnnn3Cc3ccccc3Cl)CC2)c1
0.560
Platform Score
2D Structure
EGF-01361
C19H20Cl2N6 | Exact mass: 402.1126
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
50
TPSA
403
MW
0
HBD
3.4
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 Weight403.30 Da
TPSA50.1 A^2
HBD0
HBA6
SlogP3.35
Fsp30.316
Rotatable Bonds5
Rings4 (3 aromatic)
QED0.654
SA Score2.15 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC19H20Cl2N6
Exact Mass402.1126
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes