Info
| ID | 4513 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 6} |
| Abbreviation | Ru-2b |
| SMILES | Cc1ccnc(-c2cc(C)ccn2)c1.Cc1ccnc(-c2cc(C)ccn2)c1.c1ccncc1.c1ccncc1 |
TUCAN
C34H34N6Ru/(1-35)(2-44)(3-57)(4-35)(5-45)(6-58)(7-42)(8-35)(9-60)(10-36)(11-43)(12-48)(13-59)(14-61)(15-36)(16-62)(17-64)(18-51)(19-40)(20-49)(21-36)(22-63)(23-41)(24-47)(25-52)(26-39)(27-46)(28-37)(29-50)(30-37)(31-37)(32-38)(33-38)(34-38)(35-53)(36-54)(37-55)(38-56)(39-44)(39-45)(40-53)(40-57)(41-55)(41-60)(42-53)(42-65)(43-54)(43-66)(44-58)(45-59)(46-51)(46-52)(47-54)(47-62)(48-55)(48-67)(49-56)(49-68)(50-56)(50-63)(51-61)(52-64)(57-71)(58-69)(59-69)(60-72)(61-70)(62-73)(63-74)(64-70)(65-66)(65-71)(66-73)(67-68)(67-72)(68-74)(69-75)(70-75)(71-75)(72-75)(73-75)(74-75)
Measurements (2)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| T47D | 27 | 79 | 10.1016/j.jinorgbio.2022.11193... | 2022 |
| H23 | 4.5e+02 | 2.2e+02 | 10.1016/j.jinorgbio.2022.11193... | 2022 |
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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