99129-26-7
Product Name:
2,7-Naphthalenedisulfonic acid, 4-amino-6-[[5-[(5-chloro- 2-fluoro-6-methyl-4-pyrimidinyl)amino]-2-sulfophenyl ]azo]-3-[(2,5-disulfophenyl)azo]-5-hydroxy-, potassium sodium salt
Formula:
C27H20ClFN8O16S5.xK.xNa
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COMPUTED DESCRIPTORS
| Molecular Weight | 1085.5 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 25 |
| Rotatable Bond Count | 6 |
| Exact Mass | 1083.7588712 g/mol |
| Monoisotopic Mass | 1083.7588712 g/mol |
| Topological Polar Surface Area | 461 Ų |
| Heavy Atom Count | 63 |
| Formal Charge | 0 |
| Complexity | 2050 |
| 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 | 6 |
| Compound Is Canonicalized | Yes |