956683-68-4
Product Name:
(S)-2-(1-((S)-2-aminopropanoyl)piperidine-4-carboxamido)-4-(methylthio)butanoic acid
Formula:
C14H25N3O4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 331.43 g/mol |
|---|---|
| XLogP3 | -2.7 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 7 |
| Exact Mass | 331.15657746 g/mol |
| Monoisotopic Mass | 331.15657746 g/mol |
| Topological Polar Surface Area | 138 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 411 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |