Base information
| Cat. No. | |
| CAS No. | 1022150-57-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H13N7S |
| Molecular Weight | 359.408 |
| Exact Mass | 359.095 |
| XLogP3 | 3.2242 |
| Mr | 99.131 |
| PSA | 99.09 |
| Sequence | - |
| Atom number | 39 |
| Bond number | 43 |
| Ring number | 5 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | Cn1ncc(c1)c1ccc2n(n1)c(nn2)Sc1ccc2c(c1)cccn2 |
