Info
| ID | 994 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 2, "O": 1} |
| Abbreviation | Ru2 |
| SMILES | COC(=O)C(C)([N-]c1c(C(C)C)cccc1C(C)C)/C(C)=N/c1c(C(C)C)cccc1C(C)C.OCCCc1ccccc1 |
TUCAN
C39H55N2O3Ru/(1-78)(2-66)(3-77)(4-69)(5-78)(6-59)(7-68)(8-93)(9-59)(10-59)(11-60)(12-71)(13-60)(14-85)(15-56)(16-93)(17-60)(18-67)(19-56)(20-56)(21-63)(22-72)(23-63)(24-57)(25-57)(26-57)(27-84)(28-74)(29-75)(30-86)(31-92)(32-64)(33-76)(34-58)(35-64)(36-64)(37-58)(38-70)(39-77)(40-63)(41-65)(42-73)(43-65)(44-65)(45-87)(46-58)(47-61)(48-61)(49-61)(50-62)(51-62)(52-62)(53-92)(54-92)(55-98)(56-89)(57-84)(58-84)(59-85)(60-85)(61-86)(62-86)(63-87)(64-91)(65-87)(66-68)(66-79)(67-70)(67-79)(68-69)(69-70)(71-72)(71-80)(72-73)(73-83)(74-75)(74-81)(75-76)(76-82)(77-78)(77-79)(78-93)(80-85)(80-88)(81-84)(81-90)(82-86)(82-90)(83-87)(83-88)(88-95)(89-91)(89-95)(90-96)(91-94)(91-96)(92-99)(93-98)(94-97)(94-99)(95-100)(96-100)(99-100)
Measurements (4)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A549 | 14 | — | 10.1016/j.dyepig.2020.108867 | 2021 |
| HepG2 | 17 | — | 10.1016/j.dyepig.2020.108867 | 2021 |
| HeLa | 27 | — | 10.1016/j.dyepig.2020.108867 | 2021 |
| BEAS-2B | 31 | — | 10.1016/j.dyepig.2020.108867 | 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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