home← all complexes Ir builderC^N familiesD-MPNN

Complex #2765 — Ru(2) [3]

2D Structure

Structure
⬇ MOL V3000

Info

ID2765
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 5}
Abbreviation3
SMILESCc1ccc(C(C)C)cc1.c1ccc(-c2nc3cc4ccccc4cc3nc2-c2ccccn2)nc1.c1ccncc1

TUCAN

C37H33N5Ru/(1-38)(2-54)(3-48)(4-60)(5-35)(6-35)(7-42)(8-52)(9-44)(10-37)(11-47)(12-39)(13-55)(14-62)(15-46)(16-50)(17-49)(18-45)(19-40)(20-35)(21-41)(22-36)(23-34)(24-36)(25-34)(26-36)(27-53)(28-61)(29-63)(30-64)(31-34)(32-51)(33-43)(34-56)(35-60)(36-60)(37-38)(37-58)(38-39)(39-47)(40-46)(40-61)(41-42)(41-56)(42-57)(43-51)(43-57)(44-49)(44-62)(45-49)(45-63)(46-48)(47-59)(48-65)(50-52)(50-53)(51-56)(52-69)(53-64)(54-58)(54-68)(55-59)(55-70)(57-60)(58-59)(61-71)(62-74)(63-74)(64-72)(65-66)(65-71)(66-67)(66-73)(67-69)(67-75)(68-70)(68-73)(69-72)(70-75)(73-76)(74-76)(75-76)

Measurements (6)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
L-92911— 10.1016/j.jinorgbio.2023.11231... 2023
A549284 10.1039/c4dt01755b 2014
A549284 10.1039/c5dt00939a 2015
A549cisR34— 10.1016/j.jinorgbio.2023.11231... 2023
A549479.8 10.1016/j.jinorgbio.2023.11231... 2023
HeLa48— 10.1016/j.jinorgbio.2023.11231... 2023

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.

experimental validation surface
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