Info
| ID | 1371 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 0 |
| Donor atoms | {"N": 2, "O": 2} |
| Abbreviation | 5 |
| SMILES | C/C(=C/C(=O)c1ccc(Cl)cc1)[N-]c1ccccc1.C/C(=C/C(=O)c1ccc(Cl)cc1)[N-]c1ccccc1.[C-]#[O+].[C-]#[O+] |
TUCAN
C34H26Cl2N2O4Ru/(1-36)(2-27)(3-34)(4-40)(5-35)(6-27)(7-46)(8-38)(9-30)(10-27)(11-37)(12-42)(13-29)(14-47)(15-32)(16-31)(17-28)(18-39)(19-28)(20-33)(21-41)(22-28)(23-43)(24-48)(25-44)(26-45)(27-53)(28-54)(29-34)(29-49)(30-35)(30-36)(31-35)(31-40)(32-37)(32-49)(33-42)(33-50)(34-59)(36-51)(37-59)(38-39)(38-45)(39-46)(40-51)(41-53)(41-57)(42-60)(43-47)(43-50)(44-54)(44-58)(45-48)(46-52)(47-60)(48-52)(49-57)(50-58)(51-61)(52-62)(53-61)(54-62)(55-63)(56-66)(57-64)(58-65)(59-67)(60-68)(61-69)(62-69)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MIA PaCa-2 | — | — | 10.1016/j.ica.2019.119025 | 2019 |
| HCT-116 p53+/+ | — | — | 10.1016/j.ica.2019.119025 | 2019 |
| ARPE-19 | — | — | 10.1016/j.ica.2019.119025 | 2019 |
Source-assisted 2D generator
Builds the drawing from source ligand graphs and explicit donor metadata, then uses Metal2D only for layout. Publication output uses black bonds without arrows or colour highlighting; validated octahedral enantiomers are encoded directly with solid and hashed wedge bonds.
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