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Complex #395 — Ru(2) [2]

2D Structure

Structure
⬇ MOL V3000

Info

ID395
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 7}
Abbreviation2
SMILESCCCCCCCCCCC(=O)Nc1cc2cccnc2c2ncccc12.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12

TUCAN

C47H45N7ORu/(1-69)(2-49)(3-79)(4-80)(5-57)(6-60)(7-55)(8-48)(9-61)(10-54)(11-83)(12-46)(13-46)(14-46)(15-65)(16-65)(17-64)(18-64)(19-71)(20-71)(21-70)(22-70)(23-69)(24-72)(25-72)(26-47)(27-52)(28-81)(29-63)(30-50)(31-82)(32-51)(33-67)(34-67)(35-53)(36-62)(37-56)(38-66)(39-66)(40-58)(41-59)(42-84)(43-68)(44-68)(45-93)(46-65)(47-51)(47-73)(48-49)(48-73)(49-79)(50-62)(50-74)(51-75)(52-57)(52-74)(53-60)(53-75)(54-55)(54-76)(55-81)(56-59)(56-82)(57-80)(58-61)(58-78)(59-77)(60-83)(61-84)(62-78)(63-77)(63-91)(64-65)(64-71)(66-69)(66-92)(67-68)(67-72)(68-70)(69-72)(70-71)(73-85)(74-86)(75-89)(76-87)(76-91)(77-88)(78-90)(79-94)(80-95)(81-96)(82-97)(83-98)(84-99)(85-89)(85-94)(86-90)(86-95)(87-88)(87-96)(88-97)(89-98)(90-99)(91-93)(92-93)(92-100)(94-101)(95-101)(96-101)(97-101)(98-101)(99-101)

Measurements (1)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HeLa389 10.1021/acsabm.1c00284 2021

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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