EGF-01880 Green

CN(C)C1CCN(c2ncccc2NC(=O)c2ccccn2)C1
0.583
Platform Score
2D Structure
EGF-01880
C17H21N5O | Exact mass: 311.1746
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
1
Hinge Binder
61
TPSA
311
MW
1
HBD
1.9
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 Weight311.40 Da
TPSA61.4 A^2
HBD1
HBA5
SlogP1.87
Fsp30.353
Rotatable Bonds4
Rings3 (2 aromatic)
QED0.934
SA Score2.64 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC17H21N5O
Exact Mass311.1746
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder 4-Aminoquinazoline Hinge
InChIKey-
Filter PassYes