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Complex #2680 — Ru(2) [4]

2D Structure

Structure
⬇ MOL V3000

Info

ID2680
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 8}
Abbreviation4
SMILESC1=CC2CC1CC2c1nc2c3cccnc3c3ncccc3c2[nH]1.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12

TUCAN

C44H32N8Ru/(1-34)(2-36)(3-33)(4-62)(5-39)(6-37)(7-35)(8-63)(9-47)(10-65)(11-50)(12-60)(13-49)(14-52)(15-38)(16-66)(17-67)(18-43)(19-45)(20-42)(21-48)(22-52)(23-61)(24-44)(25-41)(26-40)(27-59)(28-64)(29-46)(30-51)(31-51)(32-78)(33-34)(33-62)(34-53)(35-47)(35-63)(36-39)(36-53)(37-45)(37-56)(38-48)(38-65)(39-56)(40-43)(40-54)(41-42)(41-64)(42-55)(43-67)(44-46)(44-57)(45-66)(46-58)(47-57)(48-58)(49-50)(49-60)(50-61)(51-60)(51-61)(52-59)(52-61)(53-68)(54-71)(54-74)(55-70)(55-73)(56-69)(57-72)(58-75)(59-60)(59-76)(62-79)(63-80)(64-77)(65-82)(66-83)(67-84)(68-69)(68-79)(69-83)(70-71)(70-78)(71-81)(72-75)(72-80)(73-74)(73-77)(74-84)(75-82)(76-78)(76-81)(79-85)(80-85)(81-85)(82-85)(83-85)(84-85)

Measurements (7)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
SGC-790110 10.1007/s11243-018-0264-y 2018
BEL-740213 10.1007/s11243-018-0264-y 2018
SiHa86 10.1007/s11243-018-0264-y 2018
HeLa89 10.1007/s11243-018-0264-y 2018
PC-12 10.1007/s11243-018-0264-y 2018
HepG2 10.1007/s11243-018-0264-y 2018
A549 10.1007/s11243-018-0264-y 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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