Info
| ID | 4918 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 6} |
| Abbreviation | 3 |
| SMILES | Clc1ccc2nc3c4cccnc4c4ncccc4c3nc2c1.[c-]1ccccc1-c1nccc2ccccc12.[c-]1ccccc1-c1nccc2ccccc12 |
TUCAN
C48H29ClIrN6/(1-41)(2-45)(3-32)(4-42)(5-50)(6-38)(7-40)(8-52)(9-34)(10-48)(11-33)(12-54)(13-65)(14-39)(15-55)(16-47)(17-56)(18-46)(19-36)(20-49)(21-67)(22-44)(23-66)(24-37)(25-35)(26-51)(27-43)(28-53)(29-68)(30-40)(30-58)(31-48)(31-64)(32-34)(32-60)(33-45)(33-58)(34-50)(35-73)(35-77)(36-37)(36-61)(37-66)(38-40)(38-45)(39-49)(39-53)(41-50)(41-57)(42-60)(42-65)(43-52)(43-64)(44-53)(44-59)(46-55)(46-76)(47-56)(47-68)(48-54)(49-62)(51-62)(51-67)(52-54)(55-77)(56-63)(57-60)(57-69)(58-69)(59-62)(59-71)(61-70)(61-72)(63-74)(63-75)(64-71)(65-80)(66-79)(67-83)(68-81)(69-80)(70-74)(70-78)(71-83)(72-75)(72-79)(73-76)(73-78)(74-82)(75-81)(76-82)(77-84)(80-85)(81-85)(82-85)(83-85)
Measurements (5)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HepG2 | 6.9 | — | 10.1016/j.jinorgbio.2021.11146... | 2021 |
| HeLa | 18 | — | 10.1016/j.jinorgbio.2021.11146... | 2021 |
| NIH-3T3 | 33 | — | 10.1016/j.jinorgbio.2021.11146... | 2021 |
| A549 | 34 | — | 10.1016/j.jinorgbio.2021.11146... | 2021 |
| SGC-7901 | 36 | — | 10.1016/j.jinorgbio.2021.11146... | 2021 |
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.