CHEMICAL AND PHYSICAL PROPERTIES
| Color/Form | Orange or orange-red powder |
|---|---|
| Melting Point | 116-117 °C |
| Solubility | insoluble |
| LogP | 2.2 |
| Other Experimental Properties | Hydroxyl radical reaction rate constant = 1.1X10-10 cu-cm/molecule sec at 25 °C /Estimated/ |
COMPUTED DESCRIPTORS
| Molecular Weight | 723.6 g/mol |
|---|---|
| XLogP3 | 4 |
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 16 |
| Rotatable Bond Count | 11 |
| Exact Mass | 723.21387469 g/mol |
| Monoisotopic Mass | 723.21387469 g/mol |
| Topological Polar Surface Area | 215 Ų |
| Heavy Atom Count | 51 |
| Formal Charge | 0 |
| Complexity | 1350 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 6 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Valrubicin is an anthracycline and a trifluoroacetamide.