UPX
FEATURES
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NAMES
  • UPX
SMILES
C/C(=N\Nc1ncc[nH]1)c1ccc(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cc1
InChI
InChI=1S/C20H17N7O3/c1-12(25-26-20-21-9-10-22-20)13-5-7-15(8-6-13)23-19(28)16-11-14-3-2-4-17(27(29)30)18(14)24-16/h2-11,24H,1H3,(H,23,28)(H2,21,22,26)/b25-12+
MOLECULAR FORMULA
C20H17N7O3
CROSS REFERENCES
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UPX
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight403.14
AlogP3.89
HBond donors4
HBond acceptors10
Atoms47
Contains toxicophoreYes
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by UPX.