81409-92-9
Product Name:
N-(3-(Dimethylamino)propyl)-N-((ethylamino)carbonyl)-6-n-propylergolin e-8-beta-carboxamide
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COMPUTED DESCRIPTORS
| Molecular Weight | 453.6 g/mol |
|---|---|
| XLogP3 | 3.7 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 8 |
| Exact Mass | 453.31037550 g/mol |
| Monoisotopic Mass | 453.31037550 g/mol |
| Topological Polar Surface Area | 71.7 Ų |
| Heavy Atom Count | 33 |
| Formal Charge | 0 |
| Complexity | 686 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |