Info
| ID | 4869 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 6} |
| Abbreviation | Ir2 |
| SMILES | Clc1ccc(-c2ccc(-c3nc4c5cccnc5c5ncccc5c4[nH]3)cc2)cc1.[c-]1ccccc1-c1nccc2ccccc12.[c-]1ccccc1-c1nccc2ccccc12 |
TUCAN
C55H35ClIrN6/(1-43)(2-54)(3-51)(4-40)(5-39)(6-63)(7-38)(8-52)(9-64)(10-42)(11-41)(12-55)(13-79)(14-82)(15-50)(16-45)(17-46)(18-80)(19-47)(20-65)(21-56)(22-44)(23-53)(24-60)(25-59)(26-49)(27-81)(28-48)(29-58)(30-62)(31-57)(32-61)(33-67)(34-66)(35-92)(36-52)(36-68)(37-55)(37-70)(38-40)(38-43)(39-40)(39-74)(41-54)(41-68)(42-56)(42-61)(43-69)(44-57)(44-70)(45-50)(45-90)(46-49)(46-73)(47-48)(47-81)(48-72)(49-80)(50-77)(51-74)(51-79)(52-63)(53-61)(53-71)(54-63)(55-64)(56-76)(57-64)(58-65)(58-77)(59-60)(59-78)(60-75)(62-76)(62-82)(65-90)(66-67)(66-75)(67-78)(68-83)(69-74)(69-83)(70-84)(71-76)(71-84)(72-85)(72-88)(73-86)(73-87)(75-77)(78-89)(79-93)(80-95)(81-91)(82-94)(83-93)(84-94)(85-87)(85-92)(86-88)(86-95)(87-96)(88-91)(89-92)(89-96)(90-97)(93-98)(94-98)(95-98)(96-98)
Measurements (6)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HeLa | 62 | — | 10.1016/j.jinorgbio.2022.11186... | 2022 |
| SGC-7901 | 78 | — | 10.1016/j.jinorgbio.2022.11186... | 2022 |
| A549 | — | — | 10.1016/j.jinorgbio.2022.11186... | 2022 |
| HepG2 | — | — | 10.1016/j.jinorgbio.2022.11186... | 2022 |
| BEL-7402 | — | — | 10.1016/j.jinorgbio.2022.11186... | 2022 |
| LO2 | — | — | 10.1016/j.jinorgbio.2022.11186... | 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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The generated SVG will appear here. The legacy ligand image above stays visible for side-by-side review.