EGF-07187 Red

CCc1ccc(NC(=O)CSCc2nnc(SCC(=O)Nc3ccccc3OC)n2C)cc1
0.303
Platform Score
2D Structure
EGF-07187
C23H27N5O3S2 | Exact mass: 485.1555
Key Metrics
N/A
Vina (kcal/mol)
#-
Docking Rank
0
Hinge Binder
98
TPSA
486
MW
2
HBD
4.0
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 Weight485.60 Da
TPSA98.1 A^2
HBD2
HBA8
SlogP3.99
Fsp30.304
Rotatable Bonds11
Rings3 (3 aromatic)
QED0.396
SA Score2.24 (1=easy, 10=hard)
CNS MPO- / 4.0
FormulaC23H27N5O3S2
Exact Mass485.1555
Classification
Scaffold (Murcko)-
Source Versions-
Best Source Score-
Best Source Rank#-
Hinge Binder Not present
InChIKey-
Filter PassYes