Info
| ID | 3162 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 6} |
| Abbreviation | Ru2 |
| SMILES | CC(C)(C)c1ccnc(-c2cc(C(C)(C)C)ccn2)c1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1 |
TUCAN
C38H40N6Ru/(1-54)(2-67)(3-70)(4-47)(5-49)(6-48)(7-71)(8-68)(9-53)(10-41)(11-72)(12-50)(13-41)(14-41)(15-42)(16-42)(17-42)(18-43)(19-56)(20-57)(21-52)(22-51)(23-43)(24-43)(25-62)(26-69)(27-44)(28-44)(29-44)(30-45)(31-60)(32-58)(33-59)(34-61)(35-45)(36-55)(37-45)(38-46)(39-46)(40-46)(41-65)(42-65)(43-65)(44-66)(45-66)(46-66)(47-49)(47-56)(48-50)(48-57)(49-67)(50-70)(51-52)(51-71)(52-59)(53-63)(53-68)(54-63)(54-73)(55-64)(55-69)(56-75)(57-76)(58-60)(58-72)(59-77)(60-61)(61-78)(62-64)(62-74)(63-65)(64-66)(67-79)(68-80)(69-84)(70-81)(71-82)(72-83)(73-74)(73-80)(74-84)(75-76)(75-79)(76-81)(77-78)(77-82)(78-83)(79-85)(80-85)(81-85)(82-85)(83-85)(84-85)
Measurements (6)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| B16 | 96 | 8.4 | 10.1002/asia.202300047 | 2023 |
| A431 | 1e+02 | 1.3 | 10.1002/asia.202300047 | 2023 |
| A549 | 1.3e+02 | 2.7 | 10.1002/asia.202300047 | 2023 |
| HeLa | 1.8e+02 | 9.3 | 10.1002/asia.202300047 | 2023 |
| A549cisR | — | 8.2 | 10.1002/asia.202300047 | 2023 |
| NP69 | — | 40 | 10.1002/asia.202300047 | 2023 |
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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