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Complex #1556 — Ru(2) [3]

2D Structure

Structure
⬇ MOL V3000

Info

ID1556
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 6}
Abbreviation3
SMILESO=C(O)c1ccnc(-c2ccccn2)n1.c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1.c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1

TUCAN

C46H27N11O2Ru/(1-29)(2-43)(3-28)(4-36)(5-31)(6-35)(7-40)(8-41)(9-47)(10-37)(11-54)(12-55)(13-42)(14-30)(15-39)(16-46)(17-57)(18-56)(19-52)(20-53)(21-45)(22-34)(23-38)(24-44)(25-32)(26-33)(27-86)(28-31)(28-59)(29-36)(29-48)(30-38)(30-51)(31-37)(32-57)(32-65)(33-41)(33-56)(34-40)(34-71)(35-42)(35-52)(36-54)(37-43)(38-55)(39-44)(39-53)(40-46)(41-47)(42-49)(43-62)(44-50)(45-46)(45-64)(47-66)(48-58)(48-68)(49-60)(49-67)(50-63)(50-70)(51-61)(51-69)(52-83)(53-84)(54-74)(55-75)(56-81)(57-82)(58-67)(58-76)(59-62)(59-79)(60-68)(60-83)(61-70)(61-77)(62-76)(63-69)(63-84)(64-71)(64-77)(65-73)(65-78)(66-72)(66-81)(67-79)(68-74)(69-75)(70-80)(71-80)(72-78)(72-82)(73-85)(73-86)(79-87)(80-87)(81-87)(82-87)(83-87)(84-87)

Measurements (8)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
A27802.8— 10.1021/ja307288s 2012
A2780-CP704— 10.1021/ja307288s 2012
MCF-74.3— 10.1021/ja307288s 2012
HeLa10— 10.1021/ja307288s 2012
U2OS14— 10.1021/ja307288s 2012
MRC-515— 10.1021/ja307288s 2012
HeLa165.9 10.1002/anie.201309576 2014
U2OS3014 10.1002/anie.201309576 2014

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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