home← all complexes D-MPNN

Complex #1329 — Ru(2) [3c]

2D Structure

Structure
⬇ MOL V3000

Info

ID1329
MetalRu
Oxidation state2
Charge0
Donor atoms{"N": 3}
Abbreviation3c
SMILESCc1ccc(C(C)C)cc1.N#CC1=C(N)Oc2c(cc(Cl)c3ccccc23)C1c1cccnc1.[Cl-].[Cl-]

TUCAN

C29H26ClN3ORu/(1-27)(2-32)(3-28)(4-31)(5-27)(6-48)(7-39)(8-38)(9-52)(10-36)(11-35)(12-51)(13-30)(14-34)(15-37)(16-28)(17-28)(18-27)(19-29)(20-29)(21-49)(22-29)(23-33)(24-40)(25-57)(26-57)(27-44)(28-49)(29-49)(30-43)(30-55)(31-32)(31-44)(32-45)(33-40)(33-45)(34-38)(34-52)(35-39)(35-42)(36-37)(36-39)(37-47)(38-46)(40-44)(41-48)(41-50)(41-54)(42-47)(42-53)(43-48)(43-53)(45-49)(46-48)(46-51)(47-55)(50-56)(51-58)(52-58)(53-59)(54-57)(54-59)(55-60)(58-61)(59-61)

Measurements (10)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
KB-V1/Vbl0.036 10.1016/j.jinorgbio.2018.03.01... 2018
MCF-7/Topo0.047 10.1016/j.jinorgbio.2018.03.01... 2018
U-87 MG0.073 10.1016/j.jinorgbio.2018.03.01... 2018
PANC-10.1 10.1016/j.jinorgbio.2018.03.01... 2018
518A20.12 10.1016/j.jinorgbio.2018.03.01... 2018
DLD-10.14 10.1016/j.jinorgbio.2018.03.01... 2018
HT-290.16 10.1016/j.jinorgbio.2018.03.01... 2018
HCT-1160.19 10.1016/j.jinorgbio.2018.03.01... 2018
518A2 10.1016/j.jinorgbio.2018.03.01... 2018
HDFa 10.1016/j.jinorgbio.2018.03.01... 2018