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Complex #2212 — Ru(2) [4c]

2D Structure

Structure
⬇ MOL V3000

Info

ID2212
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 5, "P": 1}
Abbreviation4c
SMILESC1N2CN3CN1CP(C2)C3.Cc1ccc(C(C)C)cc1.Cc1ccnc2c1ccc1c(C)ccnc12

TUCAN

C30H38N5PRu/(1-41)(2-41)(3-41)(4-46)(5-42)(6-42)(7-48)(8-59)(9-60)(10-47)(11-43)(12-43)(13-44)(14-43)(15-58)(16-45)(17-39)(18-50)(19-39)(20-39)(21-51)(22-40)(23-66)(24-66)(25-63)(26-63)(27-64)(28-64)(29-65)(30-67)(31-65)(32-40)(33-49)(34-40)(35-42)(36-67)(37-68)(38-68)(39-58)(40-58)(41-54)(42-55)(43-53)(44-45)(44-53)(45-52)(46-47)(46-56)(47-57)(48-54)(48-59)(49-55)(49-60)(50-51)(50-52)(51-53)(52-58)(54-56)(55-57)(56-61)(57-62)(59-72)(60-73)(61-62)(61-72)(62-73)(63-69)(63-70)(64-69)(64-71)(65-70)(65-71)(66-69)(66-74)(67-70)(67-74)(68-71)(68-74)(72-75)(73-75)(74-75)

Measurements (6)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
LN2290.88— 10.1039/d2ra02677e 2022
T98G0.97— 10.1039/d2ra02677e 2022
U-87 MG0.97— 10.1039/d2ra02677e 2022
MCF-715— 10.1016/j.jinorgbio.2020.11109... 2020
HeLa17— 10.1016/j.jinorgbio.2020.11109... 2020
HEK2931.1e+02— 10.1016/j.jinorgbio.2020.11109... 2020

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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