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Complex #2587 — Ru(2) [1]

2D Structure

Structure
⬇ MOL V3000

Info

ID2587
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 6}
Abbreviation1
SMILESCc1ccnc(-c2cc(C)ccn2)c1.Cc1ccnc(-c2cc(C)ccn2)c1.Nc1cc2nc3c4cccnc4c4ncccc4c3nc2cc1N

TUCAN

C42H36N10Ru/(1-37)(2-42)(3-61)(4-37)(5-52)(6-41)(7-62)(8-37)(9-44)(10-43)(11-53)(12-49)(13-38)(14-63)(15-66)(16-46)(17-47)(18-38)(19-38)(20-39)(21-50)(22-39)(23-48)(24-51)(25-39)(26-40)(27-65)(28-45)(29-54)(30-40)(31-40)(32-64)(33-79)(34-80)(35-79)(36-80)(37-55)(38-56)(39-59)(40-60)(41-55)(41-70)(42-68)(42-74)(43-55)(43-61)(44-56)(44-71)(45-72)(45-76)(46-56)(46-62)(47-59)(47-63)(48-60)(48-64)(49-52)(49-66)(50-51)(50-58)(51-65)(52-57)(53-59)(53-75)(54-60)(54-78)(57-69)(57-77)(58-67)(58-73)(61-84)(62-85)(63-87)(64-88)(65-86)(66-81)(67-77)(67-83)(68-76)(68-79)(69-73)(69-81)(70-71)(70-84)(71-85)(72-74)(72-83)(73-86)(74-82)(75-78)(75-87)(76-80)(77-82)(78-88)(83-89)(84-89)(85-89)(86-89)(87-89)(88-89)

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
A54920— 10.1007/s11243-013-9724-6 2013
MG-6336— 10.1007/s11243-013-9724-6 2013
BEL-740262— 10.1007/s11243-013-9724-6 2013
SK-BR-373— 10.1007/s11243-013-9724-6 2013

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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