Info
| ID | 709 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"P": 2, "S": 1, "N": 3} |
| Abbreviation | 1 |
| SMILES | C(=C\P(c1ccccc1)c1ccccc1)\P(c1ccccc1)c1ccccc1.[S-]c1ccccn1.c1ccc(-c2ccccn2)nc1 |
TUCAN
C41H34N3P2RuS/(1-64)(2-35)(3-40)(4-42)(5-39)(6-66)(7-37)(8-38)(9-41)(10-44)(11-55)(12-36)(13-58)(14-43)(15-46)(16-50)(17-45)(18-47)(19-48)(20-61)(21-49)(22-65)(23-52)(24-51)(25-56)(26-69)(27-60)(28-53)(29-62)(30-54)(31-57)(32-59)(33-70)(34-63)(35-52)(35-64)(36-56)(36-65)(37-55)(37-66)(38-39)(38-71)(39-40)(40-41)(41-44)(42-43)(42-45)(43-46)(44-71)(45-47)(46-72)(47-72)(48-49)(48-73)(49-50)(50-51)(51-53)(52-57)(53-73)(54-60)(54-74)(55-58)(56-59)(57-67)(58-75)(59-68)(60-61)(61-62)(62-63)(63-74)(64-76)(65-78)(66-77)(67-68)(67-76)(68-78)(69-70)(69-79)(70-80)(71-79)(72-79)(73-80)(74-80)(75-77)(75-81)(76-82)(77-82)(78-82)(79-82)(80-82)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MDA-MB-231 | 0.48 | — | 10.1039/d4dt01191k | 2024 |
| MCF-10A | 1.3 | — | 10.1039/d4dt01191k | 2024 |
| MCF-7 | 1.6 | — | 10.1039/d4dt01191k | 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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