Info
| ID | 1477 |
| Metal | Ru |
| Oxidation state | 3 |
| Charge | 0 |
| Donor atoms | {"N": 4, "S": 1, "O": 1} |
| Abbreviation | mer,cis-[RuCl3(dbtp)2(dmso)] |
| SMILES | CC(C)(C)c1cc(C(C)(C)C)n2ncnc2n1.CC(C)(C)c1cc(C(C)(C)C)n2ncnc2n1.CS(C)=O.[Cl-].[Cl-].[Cl-] |
TUCAN
C28H46N8ORuS/(1-49)(2-47)(3-49)(4-47)(5-59)(6-49)(7-50)(8-50)(9-73)(10-47)(11-73)(12-48)(13-50)(14-60)(15-54)(16-54)(17-54)(18-55)(19-55)(20-55)(21-56)(22-56)(23-56)(24-48)(25-58)(26-48)(27-58)(28-58)(29-73)(30-51)(31-74)(32-51)(33-69)(34-51)(35-52)(36-52)(37-52)(38-53)(39-53)(40-53)(41-57)(42-57)(43-70)(44-74)(45-57)(46-74)(47-61)(48-61)(49-62)(50-62)(51-61)(52-64)(53-64)(54-62)(55-63)(56-63)(57-64)(58-63)(59-65)(59-66)(60-67)(60-68)(61-65)(62-66)(63-68)(64-67)(65-77)(66-75)(67-78)(68-76)(69-79)(69-81)(70-80)(70-82)(71-75)(71-77)(71-79)(72-76)(72-78)(72-80)(73-84)(74-84)(77-81)(78-82)(79-85)(80-85)(81-85)(82-85)(83-84)(84-85)
Measurements (6)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| T47D | 42 | — | 10.1016/j.poly.2017.11.035 | 2017 |
| MCF-10A | 48 | — | 10.1016/j.poly.2017.11.035 | 2017 |
| MCF-7 | 57 | — | 10.1016/j.poly.2017.11.035 | 2017 |
| BALB/3T3 | 66 | — | 10.1016/j.poly.2017.11.035 | 2017 |
| A549 | 69 | — | 10.1016/j.poly.2017.11.035 | 2017 |
| MDA-MB-231 | 74 | — | 10.1016/j.poly.2017.11.035 | 2017 |
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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