Info
| ID | 3921 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 8} |
| Abbreviation | Ru3 |
| SMILES | COc1ccc(/C=C/c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1 |
TUCAN
C42H32N8ORu/(1-58)(2-41)(3-63)(4-59)(5-34)(6-60)(7-33)(8-42)(9-39)(10-37)(11-35)(12-43)(13-62)(14-48)(15-73)(16-73)(17-73)(18-50)(19-49)(20-47)(21-52)(22-44)(23-36)(24-61)(25-40)(26-38)(27-51)(28-53)(29-45)(30-54)(31-46)(32-76)(33-34)(33-58)(34-42)(35-36)(35-59)(36-44)(37-41)(37-55)(38-40)(38-56)(39-48)(39-56)(40-72)(41-62)(42-64)(43-45)(43-60)(44-65)(45-53)(46-52)(46-54)(47-49)(47-57)(48-74)(49-63)(50-51)(50-56)(51-74)(52-61)(53-67)(54-68)(55-66)(55-71)(57-69)(57-70)(58-77)(59-78)(60-79)(61-80)(62-75)(63-82)(64-65)(64-77)(65-78)(66-69)(66-75)(67-68)(67-79)(68-80)(69-82)(70-71)(70-81)(71-76)(72-76)(72-81)(73-83)(74-83)(77-84)(78-84)(79-84)(80-84)(81-84)(82-84)(83-84)
Measurements (5)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HCT-116 | 22 | — | 10.1016/j.jinorgbio.2018.04.01... | 2018 |
| HeLa | 24 | — | 10.1016/j.jinorgbio.2018.04.01... | 2018 |
| MDA-MB-231 | 62 | — | 10.1016/j.jinorgbio.2018.04.01... | 2018 |
| A375 | 62 | — | 10.1016/j.jinorgbio.2018.04.01... | 2018 |
| CCD-841-CON | 2.1e+02 | — | 10.1016/j.jinorgbio.2018.04.01... | 2018 |
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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The generated SVG will appear here. The legacy ligand image above stays visible for side-by-side review.