home← all complexes D-MPNN

Complex #5317 — Ir(3) [5BrIr]

2D Structure

Structure
⬇ MOL V3000

Info

ID5317
MetalIr
Oxidation state3
Charge0
Donor atoms{"O": 1, "N": 3}
Abbreviation5BrIr
SMILES[O-]c1ccc(Br)c2cccnc12.[c-]1ccccc1-c1ccc2ccccc2n1.[c-]1ccccc1-c1ccc2ccccc2n1

TUCAN

C39H25BrIrN3O/(1-29)(2-38)(3-28)(4-31)(5-41)(6-36)(7-57)(8-44)(9-34)(10-33)(11-40)(12-45)(13-47)(14-35)(15-50)(16-37)(17-32)(18-43)(19-42)(20-30)(21-49)(22-51)(23-46)(24-39)(25-48)(26-30)(26-52)(27-51)(27-55)(28-41)(28-58)(29-31)(29-33)(30-40)(31-61)(32-44)(32-59)(33-42)(34-43)(34-62)(35-43)(35-46)(36-38)(36-40)(37-48)(37-64)(38-52)(39-50)(39-56)(41-53)(42-53)(44-54)(45-49)(45-55)(46-54)(47-49)(47-51)(48-63)(50-57)(52-58)(53-61)(54-62)(55-59)(56-60)(56-64)(57-67)(58-65)(59-66)(60-63)(60-67)(61-65)(62-66)(63-68)(64-69)(65-70)(66-70)(67-70)

Measurements (3)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
A549cisR0.09 10.1016/j.inoche.2022.109609 2022
A5493.7 10.1016/j.inoche.2022.109609 2022
HL-770286 10.1016/j.inoche.2022.109609 2022