82944-45-4
Product Name:
2-[[1-Hydroxy-6-[[[[5-hydroxy-6-[(2-hydroxy-5-nitrophenyl)azo]-7-sulfo-2-naphtyl]amino]carbonyl]amino]-3-sulfo-2-naphtyl]azo]benzoic acid trisodium salt
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COMPUTED DESCRIPTORS
| Molecular Weight | 884.7 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 6 |
| Hydrogen Bond Acceptor Count | 19 |
| Rotatable Bond Count | 7 |
| Exact Mass | 884.02809856 g/mol |
| Monoisotopic Mass | 884.02809856 g/mol |
| Topological Polar Surface Area | 345 Ų |
| Heavy Atom Count | 60 |
| Formal Charge | 1 |
| Complexity | 2530 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 5 |
| Covalently-Bonded Unit Count | 4 |
| Compound Is Canonicalized | Yes |