Info
| ID | 4901 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 5} |
| Abbreviation | 3 |
| SMILES | COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccnc(-c4ccccn4)c3)cc2)cc1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1 |
TUCAN
C52H41IrN5O2/(1-79)(2-50)(3-48)(4-49)(5-47)(6-59)(7-45)(8-44)(9-61)(10-52)(11-62)(12-64)(13-53)(14-65)(15-51)(16-63)(17-72)(18-69)(19-91)(20-91)(21-91)(22-90)(23-90)(24-70)(25-67)(26-57)(27-54)(28-82)(29-60)(30-80)(31-56)(32-66)(33-90)(34-73)(35-71)(36-81)(37-68)(38-58)(39-74)(40-55)(41-46)(42-50)(42-75)(43-51)(43-78)(44-45)(44-75)(45-48)(46-49)(46-56)(47-52)(47-79)(48-50)(49-51)(52-53)(53-84)(54-55)(54-68)(55-80)(56-78)(57-76)(57-89)(58-76)(58-82)(59-65)(59-81)(60-67)(60-83)(61-64)(61-93)(62-65)(62-86)(63-66)(63-87)(64-85)(66-92)(67-77)(68-88)(69-72)(69-93)(70-73)(70-87)(71-74)(71-83)(72-85)(73-92)(74-77)(75-84)(76-77)(78-88)(79-95)(80-96)(81-98)(82-97)(83-94)(84-95)(85-94)(86-89)(86-98)(87-94)(88-96)(89-97)(90-99)(91-100)(92-99)(93-100)(95-101)(96-101)(97-101)(98-101)(100-101)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| 16HBE | 2.6 | — | 10.1016/j.jinorgbio.2019.11075... | 2019 |
| A549 | 5.8 | — | 10.1016/j.jinorgbio.2019.11075... | 2019 |
| BEAS-2B | 5.8 | — | 10.1016/j.jinorgbio.2019.11075... | 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.