Base information
| Cat. No. | |
| CAS No. | 87691-87-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H13N3S |
| Molecular Weight | 219.306 |
| Exact Mass | 219.083 |
| XLogP3 | 2.0997 |
| Mr | 70.9787 |
| PSA | 56.4 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 30 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N1CCN(CC1)c1nsc2c1cccc2 |
