EGF-00167 Green

O=C(CSc1cc(Cl)ccc1Cl)NC(=O)Nc1cccc(Cl)c1
0.631
Platform Score
2D Structure
EGF-00167
C15H11Cl3N2O2S | Exact mass: 387.9607
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
58
TPSA
390
MW
2
HBD
5.1
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 Weight389.70 Da
TPSA58.2 A^2
HBD2
HBA3
SlogP5.09
Fsp30.067
Rotatable Bonds4
Rings2 (2 aromatic)
QED0.716
SA Score1.99 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC15H11Cl3N2O2S
Exact Mass387.9607
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes