34681-77-1
Product Name:
5alpha-bromo-6beta-chloro-3beta,17alpha-dihydroxypregnane-21-carboxylic acid gamma-lactone
Formula:
C22H32BrClO3
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COMPUTED DESCRIPTORS
| Molecular Weight | 459.8 g/mol |
|---|---|
| XLogP3 | 5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 0 |
| Exact Mass | 458.12234 g/mol |
| Monoisotopic Mass | 458.12234 g/mol |
| Topological Polar Surface Area | 46.5 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 672 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 9 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |