Info
| ID | 1031 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 0 |
| Donor atoms | {"N": 4, "O": 3} |
| Abbreviation | 2 |
| SMILES | Cc1ccc(C(C)C)cc1.Cc1nn(-c2ccccc2)c([O-])c1/C(=N/Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccccc1.[Cl-] |
TUCAN
C33H31N6O5Ru/(1-33)(2-33)(3-33)(4-34)(5-40)(6-49)(7-44)(8-35)(9-36)(10-38)(11-41)(12-37)(13-52)(14-35)(15-47)(16-39)(17-35)(18-42)(19-48)(20-50)(21-32)(22-32)(23-34)(24-43)(25-34)(26-51)(27-57)(28-32)(29-45)(30-46)(31-65)(32-54)(33-57)(34-57)(35-62)(36-41)(36-52)(37-42)(37-58)(38-39)(38-53)(39-47)(40-41)(40-63)(42-59)(43-45)(43-54)(44-52)(44-63)(45-55)(46-51)(46-55)(47-50)(48-50)(48-53)(49-58)(49-60)(51-54)(53-61)(55-57)(56-61)(56-62)(56-64)(58-67)(59-60)(59-65)(60-68)(61-69)(62-70)(63-66)(64-66)(64-71)(65-69)(66-70)(67-74)(67-75)(68-72)(68-73)(69-76)(70-76)
Measurements (6)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MCF-10A | 28 | — | 10.1021/acs.inorgchem.8b01935 | 2018 |
| HCT-116 | 1.1e+02 | — | 10.1021/acs.inorgchem.8b01935 | 2018 |
| MCF-7CR | 1.2e+02 | — | 10.1021/acs.inorgchem.8b01935 | 2018 |
| MCF-7 | 1.3e+02 | — | 10.1021/acs.inorgchem.8b01935 | 2018 |
| HeLa | — | — | 10.1021/acs.inorgchem.8b01935 | 2018 |
| HepG2 | — | — | 10.1021/acs.inorgchem.8b01935 | 2018 |
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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