Base information
| Cat. No. | |
| CAS No. | 1075237-97-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H13N3O4 |
| Molecular Weight | 251.239 |
| Exact Mass | 251.091 |
| XLogP3 | -0.6742 |
| Mr | 63.4896 |
| PSA | 97.47 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 32 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | OCC(n1c(=O)cnc2c1nc(OC)cc2)CO |
