Info
| ID | 2409 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"O": 1, "N": 5} |
| Abbreviation | Ru-12 |
| SMILES | [O-]c1ccccc1/C=N/c1ccc(F)c(Cl)c1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1 |
TUCAN
C33H24ClFN5ORu/(1-29)(2-25)(3-26)(4-45)(5-36)(6-31)(7-46)(8-47)(9-40)(10-28)(11-43)(12-34)(13-30)(14-37)(15-32)(16-38)(17-49)(18-35)(19-42)(20-48)(21-41)(22-39)(23-33)(24-27)(25-31)(25-50)(26-54)(26-57)(27-33)(27-44)(28-35)(28-56)(29-31)(29-45)(30-37)(30-51)(32-38)(32-52)(33-34)(34-43)(35-54)(36-38)(36-46)(37-40)(39-41)(39-53)(40-47)(41-42)(42-48)(43-55)(44-49)(44-55)(45-58)(46-59)(47-60)(48-61)(49-62)(50-51)(50-58)(51-60)(52-53)(52-59)(53-61)(54-62)(55-63)(56-57)(56-64)(57-65)(58-66)(59-66)(60-66)(61-66)(62-66)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| CEM | 36 | — | 10.1016/j.bmc.2007.08.014 | 2007 |
| L1210 | 44 | — | 10.1016/j.bmc.2007.08.014 | 2007 |
| Molt4/C8 | 50 | — | 10.1016/j.bmc.2007.08.014 | 2007 |
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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