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Complex #2889 — Ru(2) [2]

2D Structure

Structure
⬇ MOL V3000

Info

ID2889
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 6}
Abbreviation2
SMILESCc1ccc2ccc3ccc(C)nc3c2n1.Cc1ccc2ccc3ccc(C)nc3c2n1.Nc1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1

TUCAN

C47H37N9Ru/(1-43)(2-38)(3-45)(4-42)(5-38)(6-44)(7-38)(8-39)(9-50)(10-48)(11-39)(12-39)(13-58)(14-51)(15-52)(16-49)(17-53)(18-47)(19-40)(20-70)(21-57)(22-40)(23-54)(24-69)(25-46)(26-40)(27-41)(28-55)(29-59)(30-41)(31-56)(32-61)(33-60)(34-41)(35-87)(36-85)(37-85)(38-73)(39-75)(40-79)(41-81)(42-49)(42-62)(43-45)(43-73)(44-46)(44-75)(45-65)(46-66)(47-54)(47-65)(48-50)(48-64)(49-78)(50-70)(51-55)(51-79)(52-53)(52-62)(53-78)(54-66)(55-67)(56-61)(56-81)(57-58)(57-69)(58-63)(59-60)(59-67)(60-68)(61-68)(62-84)(63-72)(63-83)(64-71)(64-82)(65-74)(66-76)(67-77)(68-80)(69-93)(70-86)(71-72)(71-87)(72-91)(73-88)(74-76)(74-88)(75-89)(76-89)(77-80)(77-90)(78-85)(79-90)(80-92)(81-92)(82-83)(82-86)(83-93)(84-87)(84-91)(88-94)(89-94)(90-94)(91-94)(92-94)(93-94)

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
BEL-740237— 10.1007/s11243-010-9386-6 2010
MCF-738— 10.1007/s11243-010-9386-6 2010
C61e+02— 10.1007/s11243-010-9386-6 2010
HepG21.3e+02— 10.1007/s11243-010-9386-6 2010

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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