Base information
| Cat. No. | |
| CAS No. | 205057-15-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C27H15N4NiO4 |
| Molecular Weight | 519.134 |
| Exact Mass | 518.052 |
| XLogP3 | 3.74046 |
| Mr | 135.195 |
| PSA | 169.55 |
| Sequence | - |
| Atom number | 52 |
| Bond number | 57 |
| Ring number | 7 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N#CC1=C(C#N)N2=Cc3c([O-][Ni+2]42N1=Cc1c([O-]4)ccc2c1cccc2)c(cc1c3cccc1)C(=O)[O-].[H+] |
