Base information
| Cat. No. | |
| CAS No. | 25809-91-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H8N2S |
| Molecular Weight | 176.238 |
| Exact Mass | 176.041 |
| XLogP3 | 2.6008 |
| Mr | 51.8937 |
| PSA | 60.77 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | S=c1nc(C)c2c([nH]1)cccc2 |
