Info
| ID | 4028 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 5, "O": 1} |
| Abbreviation | Complex-2 |
| SMILES | CCCCOc1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1[N+](=O)[O-].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1 |
TUCAN
C43H35N9O3Ru/(1-57)(2-40)(3-51)(4-38)(5-46)(6-37)(7-41)(8-39)(9-53)(10-52)(11-42)(12-61)(13-62)(14-65)(15-36)(16-36)(17-36)(18-57)(19-43)(20-77)(21-77)(22-44)(23-49)(24-50)(25-47)(26-48)(27-64)(28-56)(29-66)(30-45)(31-56)(32-63)(33-54)(34-55)(35-80)(36-57)(37-38)(37-67)(38-40)(39-41)(39-42)(40-61)(41-68)(42-62)(43-44)(43-58)(44-64)(45-59)(45-75)(46-52)(46-59)(47-49)(47-69)(48-50)(48-70)(49-54)(50-55)(51-53)(51-60)(52-78)(53-63)(54-65)(55-66)(56-57)(56-77)(58-71)(58-72)(59-76)(60-73)(60-74)(61-82)(62-83)(63-87)(64-79)(65-84)(66-85)(67-68)(67-82)(68-83)(69-70)(69-84)(70-85)(71-74)(71-80)(72-73)(72-79)(73-87)(74-86)(75-78)(75-81)(76-80)(76-86)(77-88)(78-88)(81-89)(81-90)(82-91)(83-91)(84-91)(85-91)(86-91)(87-91)
Measurements (1)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MCF-7 | 2.3 | — | 10.1002/aoc.5332 | 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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