Info
| ID | 1531 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 8} |
| Abbreviation | [Ru-o-OH]2+ |
| SMILES | Oc1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)c(O)c1.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12 |
TUCAN
C43H28N8O2Ru/(1-29)(2-30)(3-33)(4-55)(5-32)(6-31)(7-38)(8-43)(9-39)(10-56)(11-45)(12-44)(13-40)(14-58)(15-59)(16-57)(17-42)(18-47)(19-41)(20-37)(21-35)(22-36)(23-34)(24-46)(25-60)(26-73)(27-81)(28-80)(29-30)(29-55)(30-48)(31-41)(31-56)(32-38)(32-48)(33-39)(33-49)(34-37)(34-58)(35-36)(35-59)(36-51)(37-50)(38-49)(39-57)(40-42)(40-52)(41-52)(42-53)(43-70)(43-71)(44-45)(44-54)(45-71)(46-47)(46-53)(47-60)(48-61)(49-62)(50-63)(50-66)(51-65)(51-68)(52-64)(53-67)(54-69)(54-70)(55-74)(56-75)(57-76)(58-72)(59-79)(60-77)(61-62)(61-74)(62-76)(63-65)(63-73)(64-67)(64-75)(65-78)(66-68)(66-72)(67-77)(68-79)(69-73)(69-78)(70-80)(71-81)(74-82)(75-82)(76-82)(77-82)(78-82)(79-82)(80-82)(81-82)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| BEL-7402 | 12 | — | 10.1016/j.ica.2017.09.056 | 2017 |
| NCI-H460 | 30 | — | 10.1016/j.ica.2017.09.056 | 2017 |
| HBMEC | — | — | 10.1016/j.ica.2017.09.056 | 2017 |
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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