EGF-01412 Green

COCCN(C(=O)c1cccc(Cl)c1)c1cc(Cl)ncn1
0.585
Platform Score
2D Structure
EGF-01412
C14H13Cl2N3O2 | Exact mass: 325.0385
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
55
TPSA
326
MW
0
HBD
3.1
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 Weight326.20 Da
TPSA55.3 A^2
HBD0
HBA4
SlogP3.08
Fsp30.214
Rotatable Bonds5
Rings2 (2 aromatic)
QED0.793
SA Score2.33 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC14H13Cl2N3O2
Exact Mass325.0385
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes