Base information
| Cat. No. | |
| CAS No. | 59443-02-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H31NO |
| Molecular Weight | 313.477 |
| Exact Mass | 313.241 |
| XLogP3 | 5.6118 |
| Mr | 102.506 |
| PSA | 22 |
| Sequence | - |
| Atom number | 54 |
| Bond number | 55 |
| Ring number | 2 |
| Rotor number | 10 |
| Residues number | 0 |
| Canonical smiles | CCCCCCCCCCCc1cc(=O)c2c(n1C)cccc2 |