znp

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 11
Total Number of Articles : 6
PubChem 44543638
Molecular Formula

C10H12N2O3

SMILES

C1=CC=C(C=C1)C[C@H](C[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C10H12N2O3/c11-10(13)9(7-12(14)15)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H2,11,13)/t9-/m1/s1

synonyms
  • (2R)-2-benzyl-3-nitropropanamide
  • CHEMBL1236974
  • Q27468013
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Properties
Property Value
MW 208.21 g/mol
HBD 1
HBA 3
Rotatable Bond Count 4
Exact Mass 208.08479225 g/mol
Monoisotopic Mass 208.08479225 g/mol
Heavy Atom Count 15
Isotope Atom Count 0
Atom Stereo Count 1
Covalent Unit Count 1
Complexity 231
xlogp 0.9
Topological Polar Surface Area 88.9