home← all complexes D-MPNN

Complex #5502 — Ir(3) [4]

2D Structure

Structure
⬇ MOL V3000

Info

ID5502
MetalIr
Oxidation state3
Charge1
Donor atoms{"N": 8}
Abbreviation4
SMILESCCN(CC)c1ccc2c(c1)Oc1cc(N(CC)CC)ccc1C21c2ccccc2C(=O)N1/N=C/c1cc2cccnc2c2ncccc12.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1

TUCAN

C63H54IrN8O2/(1-55)(2-99)(3-64)(4-62)(5-55)(6-102)(7-80)(8-100)(9-63)(10-104)(11-65)(12-104)(13-101)(14-81)(15-72)(16-55)(17-56)(18-79)(19-69)(20-61)(21-67)(22-82)(23-75)(24-56)(25-76)(26-87)(27-68)(28-103)(29-73)(30-105)(31-105)(32-56)(33-57)(34-57)(35-89)(36-71)(37-106)(38-57)(39-58)(40-77)(41-106)(42-85)(43-70)(44-83)(45-58)(46-86)(47-84)(48-107)(49-58)(50-78)(51-107)(52-74)(53-66)(54-88)(55-104)(56-105)(57-106)(58-107)(59-64)(59-90)(60-66)(60-91)(61-64)(61-87)(62-63)(62-99)(63-65)(65-108)(66-70)(67-68)(67-69)(68-109)(69-100)(70-88)(71-110)(71-115)(72-73)(72-92)(73-110)(74-94)(74-98)(75-79)(75-95)(76-85)(76-101)(77-78)(77-93)(78-102)(79-80)(80-81)(81-96)(82-87)(82-90)(83-88)(83-91)(84-112)(84-116)(85-98)(86-89)(86-97)(89-112)(90-108)(91-109)(92-114)(92-115)(93-94)(93-111)(94-103)(95-96)(95-117)(96-114)(97-114)(97-116)(98-113)(99-122)(100-123)(101-124)(102-118)(103-125)(104-119)(105-119)(106-120)(107-120)(108-122)(109-123)(110-119)(111-113)(111-118)(112-120)(113-124)(114-121)(115-127)(116-127)(117-121)(117-126)(121-125)(122-128)(123-128)(124-128)(125-128)(127-128)

Measurements (5)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
BEAS-2B24— 10.1016/j.dyepig.2018.10.019 2019
16HBE26— 10.1016/j.dyepig.2018.10.019 2019
HepG228— 10.1016/j.dyepig.2018.10.019 2019
HeLa42— 10.1016/j.dyepig.2018.10.019 2019
A549—— 10.1016/j.dyepig.2018.10.019 2019