Info
| ID | 3664 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 6} |
| Abbreviation | Ru2 |
| SMILES | [c-]1cccc2c1c1nccnc1c1c3ccccc3ccc21.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1 |
TUCAN
C40H27N6Ru/(1-48)(2-42)(3-45)(4-30)(5-32)(6-58)(7-59)(8-31)(9-60)(10-44)(11-49)(12-33)(13-61)(14-56)(15-57)(16-29)(17-39)(18-34)(19-35)(20-38)(21-37)(22-40)(23-46)(24-43)(25-41)(26-47)(27-36)(28-36)(28-51)(29-31)(29-62)(30-31)(30-58)(32-33)(32-59)(33-39)(34-35)(34-41)(35-60)(36-38)(37-38)(37-53)(39-63)(40-46)(40-47)(41-65)(42-45)(42-48)(43-44)(43-55)(44-52)(45-49)(46-61)(47-67)(48-54)(49-52)(50-54)(50-55)(50-64)(51-53)(51-66)(52-54)(53-55)(56-57)(56-71)(57-68)(58-69)(59-70)(60-72)(61-73)(62-67)(62-69)(63-65)(63-70)(64-66)(64-68)(65-72)(66-71)(67-73)(68-74)(69-74)(70-74)(71-74)(72-74)(73-74)
Measurements (7)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| LO2 | 2.8 | — | 10.1016/j.jinorgbio.2021.11138... | 2021 |
| HUVEC | 4.5 | — | 10.1016/j.jinorgbio.2021.11138... | 2021 |
| SW620 | 7.7 | — | 10.1016/j.jinorgbio.2021.11138... | 2021 |
| MCF-10A | 9.3 | — | 10.1016/j.jinorgbio.2021.11138... | 2021 |
| MDA-MB-231 | 11 | — | 10.1016/j.jinorgbio.2021.11138... | 2021 |
| SW620/AD300 | 16 | — | 10.1016/j.jinorgbio.2021.11138... | 2021 |
| MCF-7 | — | — | 10.1016/j.jinorgbio.2021.11138... | 2021 |
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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