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Complex #1344 — Ru(2) [1]

2D Structure

Structure
⬇ MOL V3000

Info

ID1344
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 6}
Abbreviation1
SMILESCc1ccnc(-c2cc(C)ccn2)c1.Cc1ccnc(-c2cc(C)ccn2)c1.c1cc2c3c(cccc3c1)-c1nc3c(ccc4nc5c6cccnc6c6ncccc6c5nc43)nc1-2

TUCAN

C54H38N10Ru/(1-39)(2-78)(3-39)(4-75)(5-73)(6-45)(7-57)(8-59)(9-44)(10-39)(11-40)(12-40)(13-40)(14-46)(15-47)(16-74)(17-48)(18-60)(19-49)(20-50)(21-58)(22-56)(23-52)(24-61)(25-43)(26-51)(27-76)(28-41)(29-54)(30-55)(31-41)(32-53)(33-41)(34-42)(35-62)(36-42)(37-42)(38-77)(39-66)(40-67)(41-68)(42-72)(43-50)(43-64)(44-66)(44-73)(45-66)(45-84)(46-67)(46-74)(47-67)(47-85)(48-50)(48-65)(49-51)(49-56)(51-64)(52-68)(52-76)(53-72)(53-77)(54-55)(54-89)(55-79)(56-69)(57-59)(57-75)(58-60)(58-78)(59-70)(60-71)(61-68)(61-88)(62-72)(62-92)(63-64)(63-65)(63-69)(65-81)(69-87)(70-83)(70-90)(71-80)(71-91)(73-97)(74-99)(75-94)(76-100)(77-102)(78-96)(79-82)(79-93)(80-83)(80-96)(81-87)(81-93)(82-86)(82-98)(83-94)(84-85)(84-97)(85-99)(86-89)(86-95)(87-98)(88-92)(88-100)(89-101)(90-91)(90-101)(91-95)(92-102)(97-103)(98-103)(99-103)(100-103)(101-103)(102-103)

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
A54924— 10.1016/j.poly.2015.12.058 2015
MG-6335— 10.1016/j.poly.2015.12.058 2015
HeLa39— 10.1016/j.poly.2015.12.058 2015
BEL-740259— 10.1016/j.poly.2015.12.058 2015

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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