Info
| ID | 5101 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 6} |
| Abbreviation | 2 |
| SMILES | CCNc1cc2c(cc1C)C1(c3cc(C)c(NCC)cc3O2)c2ccccc2C(=O)N1/N=C/c1ccnc(-c2cc(C)ccn2)c1.Cc1c(C)c(C)[c-](-c2ccc(-c3ccccc3)cc2)c1C.[Cl-] |
TUCAN
C59H57IrN6O2/(1-63)(2-58)(3-67)(4-59)(5-83)(6-104)(7-107)(8-68)(9-78)(10-107)(11-59)(12-69)(13-58)(14-63)(15-70)(16-59)(17-62)(18-74)(19-73)(20-62)(21-81)(22-61)(23-80)(24-61)(25-58)(26-60)(27-82)(28-61)(29-60)(30-84)(31-79)(32-60)(33-71)(34-65)(35-87)(36-65)(37-63)(38-65)(39-75)(40-64)(41-108)(42-108)(43-64)(44-66)(45-66)(46-66)(47-62)(48-105)(49-106)(50-76)(51-64)(52-85)(53-72)(54-86)(55-77)(56-118)(57-119)(58-90)(59-88)(60-91)(61-89)(62-92)(63-107)(64-108)(65-98)(66-103)(67-69)(67-95)(68-70)(68-96)(69-71)(70-94)(71-81)(72-73)(72-102)(73-74)(74-76)(75-109)(75-114)(76-93)(77-92)(77-110)(78-92)(78-104)(79-101)(79-112)(80-82)(80-94)(81-83)(82-96)(83-95)(84-98)(84-99)(85-111)(85-115)(86-101)(86-105)(87-100)(87-103)(88-90)(88-97)(89-91)(89-97)(90-91)(93-102)(93-113)(94-95)(96-97)(98-109)(99-113)(99-114)(100-113)(100-115)(101-106)(102-116)(103-111)(104-117)(105-121)(106-122)(107-118)(108-119)(109-118)(110-112)(110-117)(111-119)(112-121)(113-120)(114-124)(115-124)(116-120)(116-123)(120-122)(121-125)(122-125)(124-125)
Measurements (5)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A549 | 2.6 | — | 10.1039/c9dt00999j | 2019 |
| 16HBE | 2.6 | — | 10.1039/c9dt00999j | 2019 |
| BEAS-2B | 3 | — | 10.1039/c9dt00999j | 2019 |
| HeLa | 3.6 | — | 10.1039/c9dt00999j | 2019 |
| HepG2 | 5.5 | — | 10.1039/c9dt00999j | 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.