Info
| ID | 4717 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 4} |
| Abbreviation | 8 |
| SMILES | S=C(N/N=C\c1ccc(N(c2ccc(-c3ccsc3)cc2)c2ccc(-c3ccsc3)cc2)cc1)NC1CCCCC1.[Cl-].c1ccccc1 |
TUCAN
C40H38N4RuS3/(1-39)(2-40)(3-41)(4-62)(5-59)(6-74)(7-75)(8-60)(9-42)(10-59)(11-45)(12-49)(13-60)(14-62)(15-47)(16-43)(17-53)(18-46)(19-63)(20-54)(21-55)(22-61)(23-63)(24-76)(25-44)(26-50)(27-56)(28-58)(29-77)(30-61)(31-73)(32-48)(33-57)(34-51)(35-52)(36-69)(37-79)(38-81)(39-40)(39-41)(40-42)(41-43)(42-44)(43-44)(45-46)(45-65)(46-71)(47-54)(47-65)(48-50)(48-68)(49-64)(49-75)(50-70)(51-52)(51-70)(52-68)(53-55)(53-67)(54-71)(55-72)(56-57)(56-67)(57-72)(58-66)(58-77)(59-60)(59-62)(60-73)(61-63)(61-73)(62-63)(64-65)(64-74)(66-67)(66-76)(68-69)(69-82)(70-80)(71-80)(72-80)(73-79)(74-84)(75-84)(76-85)(77-85)(78-79)(78-81)(78-83)(81-82)(82-86)(84-86)(85-86)
Measurements (2)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HeLa S3 | — | — | 10.1021/acsomega.9b01022 | 2019 |
| A549 | — | — | 10.1021/acsomega.9b01022 | 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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