Info
| ID | 758 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 7} |
| Abbreviation | complex 4 |
| SMILES | [Cl-].c1cc(N2CCCC2)c2ccc3c(N4CCCC4)ccnc3c2n1.c1ccc(-c2cccc(-c3ccccn3)n2)nc1 |
TUCAN
C35H33N7Ru/(1-54)(2-40)(3-57)(4-57)(5-42)(6-41)(7-35)(8-34)(9-36)(10-53)(11-56)(12-58)(13-47)(14-47)(15-48)(16-48)(17-58)(18-59)(19-46)(20-49)(21-59)(22-49)(23-39)(24-60)(25-44)(26-60)(27-38)(28-50)(29-45)(30-50)(31-37)(32-55)(33-43)(34-38)(34-62)(35-37)(35-53)(36-43)(36-63)(37-40)(38-39)(39-55)(40-61)(41-54)(41-65)(42-43)(42-64)(44-45)(44-51)(45-52)(46-56)(46-66)(47-48)(47-57)(48-58)(49-50)(49-59)(50-60)(51-65)(51-67)(52-66)(52-68)(53-75)(54-73)(55-69)(56-74)(57-70)(58-70)(59-71)(60-71)(61-64)(61-75)(62-63)(62-69)(63-72)(64-72)(65-70)(66-71)(67-68)(67-73)(68-74)(72-76)(73-76)(74-76)(75-76)
Measurements (11)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HCT-116 | 3.2 | — | 10.1039/d2dt02332f | 2022 |
| HL60 | 3.2 | — | 10.1039/d2dt02332f | 2022 |
| CEM | 4.6 | — | 10.1039/d2dt02332f | 2022 |
| HL60 | 7.3 | — | 10.1016/j.molstruc.2024.140044 | 2024 |
| A549 | 7.9 | — | 10.1039/d2dt02332f | 2022 |
| CCRF-CEM | 9.6 | — | 10.1016/j.molstruc.2024.140044 | 2024 |
| HepG2 | 9.9 | — | 10.1039/d2dt02332f | 2022 |
| LO2 | 11 | — | 10.1039/d2dt02332f | 2022 |
| Jurkat | 15 | — | 10.1016/j.molstruc.2024.140044 | 2024 |
| U937 | 18 | — | 10.1016/j.molstruc.2024.140044 | 2024 |
| LO2 | 24 | — | 10.1016/j.molstruc.2024.140044 | 2024 |
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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