Info
| ID | 2410 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 0 |
| Donor atoms | {"O": 2, "N": 4} |
| Abbreviation | 5 |
| SMILES | [O-]c1c([O-])c(Br)c(Br)c(Br)c1Br.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1 |
TUCAN
C54H32Br4N4O2Ru/(1-40)(2-34)(3-35)(4-36)(5-41)(6-33)(7-73)(8-45)(9-42)(10-38)(11-39)(12-74)(13-43)(14-75)(15-37)(16-48)(17-44)(18-49)(19-46)(20-51)(21-52)(22-76)(23-55)(24-56)(25-53)(26-57)(27-54)(28-60)(29-47)(30-50)(31-59)(32-58)(33-62)(33-73)(34-35)(34-40)(35-36)(36-41)(37-38)(37-46)(38-45)(39-64)(39-74)(40-65)(41-65)(42-43)(42-61)(43-63)(44-66)(44-75)(45-67)(46-48)(47-50)(47-71)(48-67)(49-51)(49-68)(50-72)(51-56)(52-70)(52-76)(53-55)(53-68)(54-57)(54-69)(55-56)(57-58)(58-59)(59-60)(60-69)(61-62)(61-77)(62-65)(63-64)(63-78)(64-67)(66-68)(66-71)(69-70)(70-72)(71-79)(72-80)(73-87)(74-88)(75-89)(76-90)(77-78)(77-87)(78-88)(79-80)(79-89)(80-90)(81-82)(81-84)(81-91)(82-85)(82-92)(83-84)(83-86)(83-94)(84-93)(85-86)(85-96)(86-95)(87-97)(88-97)(89-97)(90-97)
Measurements (7)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A2780 | 10 | — | 10.1021/jacs.9b12464 | 2020 |
| HeLa | 10 | — | 10.1021/jacs.9b12464 | 2020 |
| CT-26 LUC | 12 | — | 10.1021/jacs.9b12464 | 2020 |
| CT-26 | 13 | — | 10.1021/jacs.9b12464 | 2020 |
| A2780/ADR | 15 | — | 10.1021/jacs.9b12464 | 2020 |
| A2780cisR | 17 | — | 10.1021/jacs.9b12464 | 2020 |
| RPE-1 | 23 | — | 10.1021/jacs.9b12464 | 2020 |
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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