alpha-fluoromethylhistidine

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 35
Total Number of Articles : 132
PubChem 37888687
Molecular Formula

C7H10FN3O2

SMILES

C1=C(NC=N1)C[C@@](CF)(C(=O)[O-])[NH3+]

InChI

InChI=1S/C7H10FN3O2/c8-3-7(9,6(12)13)1-5-2-10-4-11-5/h2,4H,1,3,9H2,(H,10,11)(H,12,13)/t7-/m1/s1

synonyms
  • alpha-Fluoromethylhistidine
  • Histidine, alpha-(fluoromethyl)-
  • (R,S)-alpha-(fluoromethyl)histidine
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Properties
Property Value
MW 187.17 g/mol
HBD 2
HBA 4
Rotatable Bond Count 3
Exact Mass 187.07570473 g/mol
Monoisotopic Mass 187.07570473 g/mol
Heavy Atom Count 13
Isotope Atom Count 0
Atom Stereo Count 1
Covalent Unit Count 1
Complexity 197
xlogp -2.4
Topological Polar Surface Area 96.4