home← all complexes Ir builderC^N familiesD-MPNN

Complex #43 — Ru(2) [3b]

2D Structure

Structure
⬇ MOL V3000

Info

ID43
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 8}
Abbreviation3b
SMILESCOc1ccccc1-c1nc2c3cccnc3c3ncccc3c2[nH]1.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12

TUCAN

C44H30N8ORu/(1-58)(2-50)(3-43)(4-40)(5-31)(6-33)(7-34)(8-59)(9-42)(10-61)(11-32)(12-49)(13-73)(14-73)(15-44)(16-47)(17-39)(18-60)(19-63)(20-45)(21-73)(22-62)(23-46)(24-36)(25-38)(26-35)(27-37)(28-41)(29-48)(30-76)(31-33)(31-58)(32-47)(32-59)(33-51)(34-39)(34-52)(35-38)(35-53)(36-37)(36-57)(37-60)(38-63)(39-61)(40-42)(40-51)(41-48)(41-62)(42-52)(43-44)(43-50)(44-49)(45-46)(45-54)(46-55)(47-54)(48-55)(49-74)(50-56)(51-64)(52-65)(53-67)(53-70)(54-66)(55-68)(56-72)(56-74)(57-69)(57-71)(58-77)(59-78)(60-75)(61-79)(62-81)(63-82)(64-65)(64-77)(65-79)(66-68)(66-78)(67-71)(67-80)(68-81)(69-70)(69-75)(70-82)(71-76)(72-76)(72-80)(73-83)(74-83)(77-84)(78-84)(79-84)(80-84)(81-84)(82-84)(83-84)

Measurements (12)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HepG214— 10.1021/ic100277w 2010
A37520— 10.1021/ic100277w 2010
BEL-740240— 10.1016/j.jinorgbio.2007.07.03... 2007
SW62059— 10.1021/ic100277w 2010
L121061— 10.1016/j.jinorgbio.2007.07.03... 2007
HL6072— 10.1016/j.jinorgbio.2007.07.03... 2007
KB88— 10.1016/j.jinorgbio.2007.07.03... 2007
HepG2—— 10.1016/j.ejmech.2018.12.041 2019
A549—— 10.1016/j.ejmech.2018.12.041 2019
MDA-MB-231—— 10.1016/j.ejmech.2018.12.041 2019
CNE-1—— 10.1016/j.ejmech.2018.12.041 2019
HaCaT—— 10.1016/j.ejmech.2018.12.041 2019

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
Loading source metadata…
The generated SVG will appear here. The legacy ligand image above stays visible for side-by-side review.