Base information
| Cat. No. | |
| CAS No. | 81115-63-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H7N3O2 |
| Molecular Weight | 177.16 |
| Exact Mass | 177.054 |
| XLogP3 | 1.4245 |
| Mr | 47.4574 |
| PSA | 92 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1ccc2c(c1N)cn[nH]2 |
