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Complex #138 — Ru(2) [3]

2D Structure

Structure
⬇ MOL V3000

Info

ID138
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 6}
Abbreviation3
SMILESCc1cccc(-c2cccc(C)n2)n1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1

TUCAN

C32H28N6Ru/(1-35)(2-32)(3-31)(4-41)(5-49)(6-50)(7-38)(8-29)(9-42)(10-29)(11-34)(12-51)(13-52)(14-33)(15-40)(16-39)(17-29)(18-37)(19-36)(20-30)(21-44)(22-45)(23-46)(24-47)(25-48)(26-43)(27-30)(28-30)(29-55)(30-56)(31-32)(31-49)(32-35)(33-34)(33-50)(34-41)(35-53)(36-37)(36-54)(37-38)(38-55)(39-40)(39-51)(40-46)(41-57)(42-43)(42-56)(43-48)(44-45)(44-52)(45-47)(46-58)(47-59)(48-60)(49-61)(50-62)(51-63)(52-64)(53-57)(53-61)(54-60)(54-65)(55-65)(56-66)(57-62)(58-59)(58-63)(59-64)(60-66)(61-67)(62-67)(63-67)(64-67)(65-67)(66-67)

Measurements (6)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
A5491314 10.1007/s00775-020-01835-7 2020
A5491.5e+021.1 10.1021/ja3009677 2012
A54911 10.1021/acs.inorgchem.3c03716 2024
HL601.6 10.1021/ja3009677 2012
MDA-MB-231 10.1007/s00775-020-01835-7 2020
HEK293T 10.1021/acs.inorgchem.4c00922 2024

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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