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Complex #825 — Ru(2) [Ru1]

2D Structure

Structure
⬇ MOL V3000

Info

ID825
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 8}
AbbreviationRu1
SMILESc1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc2c(c1)oc1cc(-c3nc4c5cccnc5c5ncccc5c4[nH]3)ccc12

TUCAN

C45H30N8ORu/(1-40)(2-35)(3-33)(4-45)(5-42)(6-60)(7-48)(8-34)(9-61)(10-59)(11-41)(12-62)(13-36)(14-49)(15-51)(16-63)(17-31)(18-32)(19-37)(20-39)(21-38)(22-46)(23-52)(24-47)(25-44)(26-50)(27-43)(28-64)(29-53)(30-77)(31-47)(31-74)(32-38)(32-54)(33-45)(33-59)(34-35)(34-60)(35-40)(36-41)(36-62)(37-55)(37-75)(38-55)(39-46)(39-56)(40-65)(41-42)(42-66)(43-44)(43-61)(44-58)(45-57)(46-47)(48-50)(48-68)(49-50)(49-63)(51-53)(51-72)(52-53)(52-64)(54-56)(54-75)(55-73)(56-74)(57-67)(57-71)(58-69)(58-70)(59-76)(60-78)(61-80)(62-81)(63-82)(64-83)(65-68)(65-78)(66-72)(66-81)(67-70)(67-76)(68-82)(69-71)(69-79)(70-80)(71-77)(72-83)(73-77)(73-79)(74-84)(75-84)(78-85)(79-85)(80-85)(81-85)(82-85)(83-85)(84-85)

Measurements (6)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
A54923 10.1007/s00775-023-01997-0 2023
SGC-790134 10.1007/s00775-023-01997-0 2023
BEL-740237 10.1007/s00775-023-01997-0 2023
LO21.1e+02 10.1007/s00775-023-01997-0 2023
HCT-116 10.1007/s00775-023-01997-0 2023
HepG2 10.1007/s00775-023-01997-0 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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