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Complex #485 — Ru(2) [Ru1]

2D Structure

Structure
⬇ MOL V3000

Info

ID485
MetalRu
Oxidation state2
Charge1
Donor atoms{"N": 5}
AbbreviationRu1
SMILESFc1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1.[c-]1ccccc1-c1cccc(-c2ccccn2)n1

TUCAN

C37H25FN5Ru/(1-52)(2-32)(3-33)(4-40)(5-39)(6-53)(7-34)(8-31)(9-30)(10-41)(11-36)(12-37)(13-27)(14-38)(15-43)(16-35)(17-45)(18-44)(19-54)(20-46)(21-29)(22-47)(23-48)(24-28)(25-42)(26-39)(26-49)(27-28)(27-32)(28-55)(29-40)(29-41)(30-42)(30-52)(31-42)(31-60)(32-56)(33-38)(33-54)(34-35)(34-62)(35-51)(36-44)(36-47)(37-50)(37-61)(38-46)(39-41)(40-49)(43-48)(43-62)(44-57)(45-50)(45-59)(46-58)(47-53)(48-51)(49-56)(50-51)(52-65)(53-64)(54-63)(55-60)(55-66)(56-66)(57-59)(57-64)(58-61)(58-63)(59-67)(60-65)(61-67)(62-68)(64-69)(65-69)(66-69)(67-69)

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HeLa0.97 10.1039/d0dt01412e 2020
A5491.2 10.1039/d0dt01412e 2020
A549cisR1.4 10.1039/d0dt01412e 2020
LO24.3 10.1039/d0dt01412e 2020

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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