74627-31-9
Product Name:
Ergoline-8-beta-propionitrile, 6-methyl-alpha-(4-methyl-1-piperazinylc arbonyl)-
Formula:
C24H31N5O
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COMPUTED DESCRIPTORS
| Molecular Weight | 405.5 g/mol |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 405.25286063 g/mol |
| Monoisotopic Mass | 405.25286063 g/mol |
| Topological Polar Surface Area | 66.4 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 695 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 3 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |