110207-63-1
Product Name:
L-Aspartic acid, N-[N-[3-(3-benzofuranyl)-L-alanyl]-L-methionyl]- (9CI)
Formula:
C20H25N3O7S
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COMPUTED DESCRIPTORS
| Molecular Weight | 451.5 g/mol |
|---|---|
| XLogP3 | -1.7 |
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 12 |
| Exact Mass | 451.14132132 g/mol |
| Monoisotopic Mass | 451.14132132 g/mol |
| Topological Polar Surface Area | 197 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 663 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 3 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |