Info
| ID | 1522 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 4} |
| Abbreviation | 2 |
| SMILES | Cc1cc2nc3c4cccnc4c4ncccc4c3nc2cc1C.Cc1ccc(C(C)C)cc1.[Cl-] |
TUCAN
C30H28N4Ru/(1-52)(2-29)(3-34)(4-29)(5-30)(6-35)(7-36)(8-29)(9-50)(10-31)(11-30)(12-32)(13-31)(14-31)(15-40)(16-37)(17-33)(18-41)(19-33)(20-38)(21-39)(22-32)(23-30)(24-43)(25-51)(26-32)(27-42)(28-33)(29-50)(30-45)(31-50)(32-47)(33-48)(34-36)(34-45)(35-40)(35-45)(36-44)(37-38)(37-52)(38-46)(39-47)(39-53)(40-44)(41-48)(41-55)(42-43)(42-49)(43-51)(44-50)(46-54)(46-58)(47-48)(49-56)(49-57)(51-60)(52-62)(53-55)(53-59)(54-56)(54-61)(55-61)(56-59)(57-58)(57-60)(58-62)(61-63)(62-63)
Measurements (8)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MRC-5 | 0.4 | — | 10.1016/j.jinorgbio.2016.01.00... | 2016 |
| HeLa | 0.6 | — | 10.1016/j.jinorgbio.2016.01.00... | 2016 |
| MDA-MB-231 | 0.7 | — | 10.1016/j.jinorgbio.2016.01.00... | 2016 |
| A549 | 6.9 | — | 10.1016/j.jinorgbio.2016.01.00... | 2016 |
| C6 | 1.2e+02 | — | 10.1080/00958972.2018.1553298 | 2019 |
| U251 | 1.2e+02 | — | 10.1080/00958972.2018.1553298 | 2019 |
| B16 | 1e+03 | — | 10.1080/00958972.2018.1553298 | 2019 |
| HaCaT | — | — | 10.1080/00958972.2018.1553298 | 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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