Base information
| Cat. No. | |
| CAS No. | 106006-80-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H13N3OS |
| Molecular Weight | 211.284 |
| Exact Mass | 211.078 |
| XLogP3 | 1.6908 |
| Mr | 56.5661 |
| PSA | 96.25 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 28 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CC(=O)NC1CCc2c(C1)sc(n2)N |
