22342-46-7
Product Name:
(2S,3S,4R)-CIS-5-(3,4-DIAMINOTETRAHYDRO-2-THIENYL)VALERIC ACID
Formula:
C9H18N2O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 218.32 g/mol |
|---|---|
| XLogP3 | -2.7 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 218.10889899 g/mol |
| Monoisotopic Mass | 218.10889899 g/mol |
| Topological Polar Surface Area | 115 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 201 |
| 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 |