160661-60-9
Product Name:
Heptakis-(6-Mercapto-6-deoxy)-beta-Cyclodextrin
Formula:
C42H70O28S7
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COMPUTED DESCRIPTORS
| Molecular Weight | 1247.5 g/mol |
|---|---|
| XLogP3 | -8.2 |
| Hydrogen Bond Donor Count | 21 |
| Hydrogen Bond Acceptor Count | 35 |
| Rotatable Bond Count | 7 |
| Exact Mass | 1246.2098598 g/mol |
| Monoisotopic Mass | 1246.2098598 g/mol |
| Topological Polar Surface Area | 419 Ų |
| Heavy Atom Count | 77 |
| Formal Charge | 0 |
| Complexity | 1510 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 35 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |