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Complex #2626 — Ru(2) [1]

2D Structure

Structure
⬇ MOL V3000

Info

ID2626
MetalRu
Oxidation state2
Charge1
Donor atoms{"O": 1, "N": 3, "P": 2}
Abbreviation1
SMILESO=C([O-])c1ccccc1Nc1ccccc1.c1ccc(-c2ccccn2)nc1.c1ccc(P(CCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1

TUCAN

C50H44N3O2P2Ru/(1-46)(2-45)(3-51)(4-80)(5-47)(6-56)(7-89)(8-82)(9-49)(10-70)(11-55)(12-71)(13-73)(14-52)(15-53)(16-80)(17-58)(18-54)(19-89)(20-74)(21-77)(22-79)(23-90)(24-57)(25-61)(26-62)(27-90)(28-63)(29-64)(30-59)(31-65)(32-83)(33-67)(34-68)(35-60)(36-66)(37-50)(38-75)(39-72)(40-78)(41-76)(42-69)(43-48)(44-95)(45-46)(45-52)(46-91)(47-51)(47-91)(48-50)(48-69)(49-50)(49-84)(51-52)(53-54)(53-56)(54-58)(55-75)(55-82)(56-92)(57-58)(57-92)(59-61)(59-65)(60-67)(60-68)(61-62)(62-93)(63-65)(63-93)(64-67)(64-94)(66-68)(66-94)(69-81)(70-71)(70-74)(71-73)(72-75)(72-86)(73-77)(74-85)(76-78)(76-79)(77-85)(78-87)(79-83)(80-89)(80-90)(81-84)(81-88)(82-96)(83-97)(84-95)(85-95)(86-87)(86-96)(87-97)(88-98)(88-99)(89-100)(90-101)(91-100)(92-100)(93-101)(94-101)(96-102)(97-102)(100-102)(101-102)

Measurements (5)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
A27800.66— 10.1021/acs.inorgchem.4c04344 2025
A2780cisR0.96— 10.1021/acs.inorgchem.4c04344 2025
MRC-52.5— 10.1021/acs.inorgchem.4c04344 2025
MDA-MB-2312.9— 10.1021/acs.inorgchem.4c04344 2025
A5494— 10.1021/acs.inorgchem.4c04344 2025

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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