CHEMICAL AND PHYSICAL PROPERTIES
| Collision Cross Section | 262 Ų [M+Na-H2O]+ [CCS Type: DT, Method: stepped-field] |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 853.8 g/mol |
|---|---|
| XLogP3 | -9.3 |
| Hydrogen Bond Donor Count | 16 |
| Hydrogen Bond Acceptor Count | 25 |
| Rotatable Bond Count | 17 |
| Exact Mass | 853.30631624 g/mol |
| Monoisotopic Mass | 853.30631624 g/mol |
| Topological Polar Surface Area | 424 Ų |
| Heavy Atom Count | 58 |
| Formal Charge | 0 |
| Complexity | 1290 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 24 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |