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Complex #3193 — Ru(2) [3]

2D Structure

Structure
⬇ MOL V3000

Info

ID3193
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 6}
Abbreviation3
SMILESc1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1csc(-c2ccc(-c3ccc(-c4cc5cccnc5c5ncccc45)s3)s2)c1

TUCAN

C44H30N6RuS3/(1-37)(2-41)(3-57)(4-45)(5-39)(6-40)(7-35)(8-60)(9-42)(10-44)(11-46)(12-36)(13-48)(14-38)(15-69)(16-32)(17-47)(18-34)(19-31)(20-51)(21-49)(22-59)(23-58)(24-53)(25-33)(26-43)(27-50)(28-61)(29-52)(30-62)(31-43)(31-69)(32-34)(32-72)(33-38)(33-54)(34-70)(35-37)(35-64)(36-40)(36-65)(37-41)(38-58)(39-45)(39-59)(40-42)(41-57)(42-60)(43-71)(44-47)(44-73)(45-56)(46-55)(46-56)(47-74)(48-49)(48-50)(49-66)(50-61)(51-52)(51-53)(52-62)(53-68)(54-55)(54-67)(55-73)(56-63)(57-76)(58-79)(59-75)(60-77)(61-78)(62-80)(63-67)(63-75)(64-65)(64-76)(65-77)(66-68)(66-78)(67-79)(68-80)(69-83)(70-71)(70-82)(71-83)(72-74)(72-82)(73-81)(74-81)(75-84)(76-84)(77-84)(78-84)(79-84)(80-84)

Measurements (5)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
SK-MEL-28500.12 10.1111/php.13012 2018
SK-MEL-28502 10.1111/php.13012 2018
HL601.7e+020.21 10.1111/php.13012 2018
HL601.7e+022.2 10.1111/php.13012 2018
CCD1064Sk1.9e+02— 10.1111/php.13012 2018

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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