Info
| ID | 2724 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 8} |
| Abbreviation | RC2 |
| SMILES | Cc1ccnc(-c2cc(-c3nc4ccccc4[nH]3)ccn2)c1.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12 |
TUCAN
C42H30N8Ru/(1-50)(2-58)(3-34)(4-32)(5-61)(6-44)(7-62)(8-63)(9-40)(10-46)(11-43)(12-51)(13-31)(14-31)(15-48)(16-36)(17-39)(18-33)(19-47)(20-42)(21-59)(22-35)(23-41)(24-60)(25-38)(26-49)(27-45)(28-37)(29-31)(30-74)(31-54)(32-34)(32-58)(33-45)(33-52)(34-52)(35-41)(35-53)(36-40)(36-53)(37-54)(37-59)(38-57)(38-60)(39-54)(39-71)(40-61)(41-55)(42-57)(42-70)(43-51)(43-69)(44-50)(44-68)(45-56)(46-47)(46-62)(47-55)(48-49)(48-63)(49-56)(50-51)(52-64)(53-65)(55-66)(56-67)(57-72)(58-75)(59-76)(60-73)(61-77)(62-78)(63-79)(64-67)(64-75)(65-66)(65-77)(66-78)(67-79)(68-69)(68-74)(69-80)(70-71)(70-73)(71-76)(72-74)(72-80)(75-81)(76-81)(77-81)(78-81)(79-81)(80-81)
Measurements (4)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A549 | — | — | 10.1016/j.molstruc.2024.138997 | 2024 |
| BEL-7402 | — | 7.5 | 10.1016/j.molstruc.2024.138997 | 2024 |
| HeLa | — | — | 10.1016/j.molstruc.2024.138997 | 2024 |
| HepG2 | — | — | 10.1016/j.molstruc.2024.138997 | 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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