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Complex #3923 — Ru(2) [Ru5]

2D Structure

Structure
⬇ MOL V3000

Info

ID3923
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 8}
AbbreviationRu5
SMILESC/C=C/C=C/c1nc2c3cccnc3c3ncccc3c2[nH]1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1

TUCAN

C38H30N8Ru/(1-41)(2-55)(3-58)(4-33)(5-54)(6-32)(7-56)(8-42)(9-43)(10-34)(11-46)(12-31)(13-38)(14-31)(15-39)(16-47)(17-44)(18-48)(19-45)(20-35)(21-37)(22-51)(23-40)(24-57)(25-49)(26-50)(27-59)(28-31)(29-36)(30-70)(31-36)(32-33)(32-42)(33-60)(34-46)(34-61)(35-36)(35-37)(37-38)(38-68)(39-41)(39-52)(40-51)(40-58)(41-55)(42-54)(43-46)(43-56)(44-47)(44-57)(45-48)(45-59)(47-49)(48-50)(49-62)(50-63)(51-53)(52-65)(52-67)(53-64)(53-66)(54-71)(55-74)(56-72)(57-73)(58-69)(59-75)(60-62)(60-71)(61-63)(61-72)(62-73)(63-75)(64-65)(64-70)(65-76)(66-67)(66-69)(67-74)(68-70)(68-76)(71-77)(72-77)(73-77)(74-77)(75-77)(76-77)

Measurements (5)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HCT-11618 10.1016/j.jinorgbio.2018.04.01... 2018
A37535 10.1016/j.jinorgbio.2018.04.01... 2018
MDA-MB-23136 10.1016/j.jinorgbio.2018.04.01... 2018
HeLa49 10.1016/j.jinorgbio.2018.04.01... 2018
CCD-841-CON2.4e+02 10.1016/j.jinorgbio.2018.04.01... 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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