Info
| ID | 3533 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"O": 1, "N": 5} |
| Abbreviation | 1 |
| SMILES | O=[N+]([O-])c1cc(Cl)ccc1-c1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)o1.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12 |
TUCAN
C47H28ClN9O3Ru/(1-32)(2-31)(3-33)(4-57)(5-37)(6-29)(7-38)(8-58)(9-30)(10-60)(11-49)(12-34)(13-42)(14-45)(15-35)(16-39)(17-40)(18-41)(19-46)(20-59)(21-43)(22-62)(23-36)(24-44)(25-48)(26-61)(27-47)(28-77)(29-30)(29-50)(30-51)(31-32)(31-50)(32-57)(33-35)(33-58)(34-47)(34-51)(35-52)(36-46)(36-59)(37-38)(37-60)(38-53)(39-49)(39-73)(40-44)(40-54)(41-43)(41-56)(42-45)(42-52)(43-61)(44-75)(45-55)(46-55)(47-62)(48-68)(48-75)(49-74)(50-63)(51-64)(52-67)(53-65)(53-66)(54-68)(54-73)(55-70)(56-69)(56-71)(57-79)(58-80)(59-81)(60-82)(61-76)(62-83)(63-64)(63-79)(64-83)(65-69)(65-84)(66-71)(66-82)(67-70)(67-80)(68-78)(69-77)(70-81)(71-76)(72-74)(72-77)(72-84)(73-85)(74-85)(75-88)(78-86)(78-87)(79-89)(80-89)(81-89)(82-89)(83-89)(84-89)
Measurements (1)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HeLa | 36 | — | 10.1016/j.ab.2015.06.015 | 2015 |
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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