COMPUTED DESCRIPTORS
| Molecular Weight | 299.8 g/mol |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 299.1189253 g/mol |
| Monoisotopic Mass | 299.1189253 g/mol |
| Topological Polar Surface Area | 42.8 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 458 |
| 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 |
PRODUCT INTRODUCTION
description
Lergotrile is an organic heterotetracyclic compound and an organonitrogen heterocyclic compound.