N-ACETYL-L-PHENYLALANYL-4-[DIFLUORO(PHOSPHONO)METHYL]-L-PHENYLALANINAMIDE

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 10
Total Number of Articles : 5
PubChem 9547919
Molecular Formula

C21H24F2N3O6P

SMILES

CC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC2=CC=C(C=C2)C(F)(F)P(=O)(O)O)C(=O)N

InChI

InChI=1S/C21H24F2N3O6P/c1-13(27)25-18(12-14-5-3-2-4-6-14)20(29)26-17(19(24)28)11-15-7-9-16(10-8-15)21(22,23)33(30,31)32/h2-10,17-18H,11-12H2,1H3,(H2,24,28)(H,25,27)(H,26,29)(H2,30,31,32)/t17-,18-/m0/s1

synonyms
  • N-ACETYL-L-PHENYLALANYL-4-[DIFLUORO(PHOSPHONO)METHYL]-L-PHENYLALANINAMIDE
  • CHEMBL196526
  • CHEBI:47379
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Properties
Property Value
MW 483.4 g/mol
HBD 5
HBA 8
Rotatable Bond Count 10
Exact Mass 483.13707882 g/mol
Monoisotopic Mass 483.13707882 g/mol
Heavy Atom Count 33
Isotope Atom Count 0
Atom Stereo Count 2
Covalent Unit Count 1
Complexity 748
xlogp -0.4
Topological Polar Surface Area 159