CHEMICAL AND PHYSICAL PROPERTIES
| Collision Cross Section | 210.2 Ų [M-H]- [CCS Type: TW, Method: calibrated with polyalanine] |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 472.4 g/mol |
|---|---|
| XLogP3 | -2.1 |
| Hydrogen Bond Donor Count | 6 |
| Hydrogen Bond Acceptor Count | 12 |
| Rotatable Bond Count | 4 |
| Exact Mass | 472.15807632 g/mol |
| Monoisotopic Mass | 472.15807632 g/mol |
| Topological Polar Surface Area | 196 Ų |
| Heavy Atom Count | 33 |
| Formal Charge | 0 |
| Complexity | 906 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 12 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |