tiludronic acid

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 25
Total Number of Articles : 15
PubChem 60937
Molecular Formula

C7H9ClO6P2S

SMILES

C1=CC(=CC=C1SC(P(=O)(O)O)P(=O)(O)O)Cl

InChI

InChI=1S/C7H9ClO6P2S/c8-5-1-3-6(4-2-5)17-7(15(9,10)11)16(12,13)14/h1-4,7H,(H2,9,10,11)(H2,12,13,14)

synonyms
  • Tiludronic Acid
  • Tiludronate
  • 89987-06-4
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Properties
Property Value
MW 318.61 g/mol
HBD 4
HBA 7
Rotatable Bond Count 4
Exact Mass 317.9283609 g/mol
Monoisotopic Mass 317.9283609 g/mol
Heavy Atom Count 17
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 324
xlogp -0.3
Topological Polar Surface Area 140