EGF-00230 Green

Cc1nnc(CN2CCCC23CCCN(Cc2ncc[nH]2)C3)o1
0.620
Platform Score
2D Structure
EGF-00230
C16H24N6O | Exact mass: 316.2012
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
74
TPSA
316
MW
1
HBD
1.7
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 Weight316.40 Da
TPSA74.1 A^2
HBD1
HBA6
SlogP1.73
Fsp30.688
Rotatable Bonds4
Rings4 (2 aromatic)
QED0.926
SA Score3.94 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC16H24N6O
Exact Mass316.2012
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes