EGF-07130 Red

O=C1CC2(NC(N3CCCC3)=NC2=O)c2cc(Cl)ccc2N1
0.338
Platform Score
2D Structure
EGF-07130
C15H15ClN4O2 | Exact mass: 318.0884
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
74
TPSA
319
MW
2
HBD
1.5
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 Weight318.80 Da
TPSA73.8 A^2
HBD2
HBA4
SlogP1.46
Fsp30.400
Rotatable Bonds0
Rings4 (1 aromatic)
QED0.759
SA Score3.90 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC15H15ClN4O2
Exact Mass318.0884
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes