950913-56-1
Product Name:
Adenosine 5'-(tetrahydrogen triphosphate), 2'-deoxy-4'-C-ethynyl-2-fluoro-
Formula:
C12H15FN5O12P3
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COMPUTED DESCRIPTORS
| Molecular Weight | 533.19 g/mol |
|---|---|
| XLogP3 | -4.4 |
| Hydrogen Bond Donor Count | 6 |
| Hydrogen Bond Acceptor Count | 17 |
| Rotatable Bond Count | 9 |
| Exact Mass | 532.99141009 g/mol |
| Monoisotopic Mass | 532.99141009 g/mol |
| Topological Polar Surface Area | 259 Ų |
| Heavy Atom Count | 33 |
| Formal Charge | 0 |
| Complexity | 946 |
| 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 |