Melphalan

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 345
Total Number of Articles : 533
PubChem 460612
Molecular Formula

C13H18Cl2N2O2

SMILES

C1=CC(=CC=C1C[C@@H](C(=O)O)N)N(CCCl)CCCl

InChI

InChI=1S/C13H18Cl2N2O2/c14-5-7-17(8-6-15)11-3-1-10(2-4-11)9-12(16)13(18)19/h1-4,12H,5-9,16H2,(H,18,19)/t12-/m0/s1

synonyms
  • melphalan
  • 148-82-3
  • Alkeran
Click to show/hide the synonyms
Properties
Property Value
MW 305.20 g/mol
HBD 2
HBA 4
Rotatable Bond Count 8
Exact Mass 304.0745332 g/mol
Monoisotopic Mass 304.0745332 g/mol
Heavy Atom Count 19
Isotope Atom Count 0
Atom Stereo Count 1
Covalent Unit Count 1
Complexity 265
xlogp -0.5
Topological Polar Surface Area 66.6