Info
| ID | 5081 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 5} |
| Abbreviation | 1 |
| SMILES | Cc1c(C)c(C)[c-](C)c1C.Cc1ccnc(-c2cc(/C=N/N3C(=O)C4=CC=CC5C(N6CCCC6)=CC=C(C3=O)C45)ccn2)c1.[Cl-] |
TUCAN
C38H40IrN5O2/(1-46)(2-46)(3-46)(4-41)(5-41)(6-41)(7-42)(8-42)(9-42)(10-43)(11-43)(12-47)(13-68)(14-56)(15-56)(16-55)(17-67)(18-52)(19-51)(20-57)(21-69)(22-71)(23-50)(24-57)(25-53)(26-72)(27-72)(28-54)(29-73)(30-48)(31-70)(32-49)(33-73)(34-43)(35-44)(36-44)(37-44)(38-45)(39-45)(40-45)(41-58)(42-59)(43-60)(44-62)(45-63)(46-66)(47-49)(47-67)(48-66)(48-75)(49-50)(50-64)(51-53)(51-61)(52-65)(52-69)(53-74)(54-65)(54-76)(55-66)(55-71)(56-57)(56-72)(57-73)(58-59)(58-60)(59-62)(60-63)(61-68)(61-77)(62-63)(64-68)(64-78)(65-70)(67-68)(67-74)(69-79)(70-83)(71-82)(72-80)(73-80)(74-80)(75-76)(75-82)(76-79)(77-81)(77-84)(78-81)(78-85)(81-83)(82-86)(83-86)
Measurements (4)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A549 | — | — | 10.1016/j.ejmech.2019.111599 | 2019 |
| HeLa | — | — | 10.1016/j.ejmech.2019.111599 | 2019 |
| HepG2 | — | — | 10.1016/j.ejmech.2019.111599 | 2019 |
| BEAS-2B | — | — | 10.1016/j.ejmech.2019.111599 | 2019 |
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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The generated SVG will appear here. The legacy ligand image above stays visible for side-by-side review.