home← all complexes D-MPNN

Complex #5036 — Ir(3) [Ir1]

2D Structure

Structure
⬇ MOL V3000

Info

ID5036
MetalIr
Oxidation state3
Charge1
Donor atoms{"N": 6}
AbbreviationIr1
SMILESFc1c[c-]c(-c2ccccn2)c(F)c1.Fc1c[c-]c(-c2ccccn2)c(F)c1.c1cnc2c(c1)c1nccnc1c1cccnc12

TUCAN

C36H20F4IrN6/(1-23)(2-24)(3-46)(4-42)(5-26)(6-25)(7-41)(8-43)(9-34)(10-30)(11-28)(12-29)(13-32)(14-31)(15-44)(16-35)(17-45)(18-27)(19-33)(20-36)(21-28)(21-39)(22-36)(22-40)(23-30)(23-37)(24-53)(24-54)(25-29)(25-43)(26-29)(26-48)(27-55)(27-56)(28-53)(30-42)(31-35)(31-45)(32-34)(32-38)(33-35)(33-49)(34-46)(36-56)(37-50)(37-51)(38-47)(38-52)(39-48)(39-54)(40-49)(40-55)(41-44)(41-57)(42-58)(43-59)(44-62)(45-61)(46-60)(47-51)(47-60)(48-59)(49-61)(50-52)(50-57)(51-58)(52-62)(53-64)(54-63)(55-66)(56-65)(59-67)(60-67)(61-67)(62-67)

Measurements (6)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HeLa0.72— 10.1021/acs.jmedchem.8b01704 2019
A5491.1— 10.1021/acs.jmedchem.8b01704 2019
PC-32.2— 10.1021/acs.jmedchem.8b01704 2019
A549cisR2.5— 10.1021/acs.jmedchem.8b01704 2019
HepG28.4— 10.1021/acs.jmedchem.8b01704 2019
HLF11— 10.1021/acs.jmedchem.8b01704 2019