14358-89-5
Product Name:
1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetic acid, compound with 2-amino-2-(hydroxymethyl)propane-1,3-diol (1:1)
Formula:
C13H21N5O7
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COMPUTED DESCRIPTORS
| Molecular Weight | 359.34 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 5 |
| Exact Mass | 359.14409803 g/mol |
| Monoisotopic Mass | 359.14409803 g/mol |
| Topological Polar Surface Area | 182 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 439 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |