433242-31-0
Product Name:
2-(4,6-DIMETHYL-PYRIMIDIN-2-YLSULFANYL)-PROPIONIC ACID
Formula:
C9H12N2O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 212.27 g/mol |
|---|---|
| XLogP3 | 1.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 212.06194880 g/mol |
| Monoisotopic Mass | 212.06194880 g/mol |
| Topological Polar Surface Area | 88.4 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 203 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |