Info
| ID | 2464 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 0 |
| Donor atoms | {"N": 3, "O": 2} |
| Abbreviation | compound 6 |
| SMILES | Cc1ccc(C(C)C)cc1.O=C(O)CCC(=O)NCCCn1ccnc1.O=C([O-])C(=O)[O-] |
TUCAN
C22H29N3O7Ru/(1-39)(2-30)(3-30)(4-31)(5-30)(6-45)(7-46)(8-47)(9-45)(10-38)(11-44)(12-39)(13-38)(14-43)(15-46)(16-31)(17-31)(18-32)(19-42)(20-33)(21-34)(22-35)(23-36)(24-32)(25-32)(26-37)(27-37)(28-52)(29-61)(30-40)(31-42)(32-42)(33-34)(33-40)(34-41)(35-36)(35-41)(36-40)(37-45)(37-46)(38-39)(38-48)(39-49)(41-42)(43-44)(43-54)(44-53)(45-53)(46-52)(47-53)(47-54)(48-52)(48-55)(49-58)(49-61)(50-51)(50-56)(50-57)(51-59)(51-60)(54-62)(61-62)
Measurements (4)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A2780 | 3e+02 | — | 10.1021/acs.inorgchem.8b00053 | 2018 |
| A2780cisR | 4.5e+02 | — | 10.1021/acs.inorgchem.8b00053 | 2018 |
| A549 | 5.8e+02 | — | 10.1021/acs.inorgchem.8b00053 | 2018 |
| MRC-5 | — | — | 10.1021/acs.inorgchem.8b00053 | 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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