nelarabine

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 21
Total Number of Articles : 17
PubChem 3011155
Molecular Formula

C11H15N5O5

SMILES

COC1=NC(=NC2=C1N=CN2[C@H]3[C@H]([C@@H]([C@H](O3)CO)O)O)N

InChI

InChI=1S/C11H15N5O5/c1-20-9-5-8(14-11(12)15-9)16(3-13-5)10-7(19)6(18)4(2-17)21-10/h3-4,6-7,10,17-19H,2H2,1H3,(H2,12,14,15)/t4-,6-,7+,10-/m1/s1

synonyms
  • Nelarabine
  • Nelzarabine
  • 121032-29-9
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Properties
Property Value
MW 297.27 g/mol
HBD 4
HBA 9
Rotatable Bond Count 3
Exact Mass 297.10731860 g/mol
Monoisotopic Mass 297.10731860 g/mol
Heavy Atom Count 21
Isotope Atom Count 0
Atom Stereo Count 4
Covalent Unit Count 1
Complexity 377
xlogp -0.7
Topological Polar Surface Area 149