home← all complexes D-MPNN

Complex #3159 — Ru(2) [6]

2D Structure

Structure
⬇ MOL V3000

Info

ID3159
MetalRu
Oxidation state2
Charge1
Donor atoms{"O": 1, "N": 4}
Abbreviation6
SMILESCOc1ccc(C(=O)c2ccccc2)c([O-])c1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1

TUCAN

C34H27N4O3Ru/(1-50)(2-28)(3-29)(4-51)(5-52)(6-37)(7-31)(8-53)(9-33)(10-36)(11-44)(12-58)(13-58)(14-35)(15-30)(16-34)(17-40)(18-32)(19-58)(20-38)(21-47)(22-41)(23-39)(24-42)(25-43)(26-46)(27-45)(28-30)(28-50)(29-32)(29-51)(30-34)(31-39)(31-52)(32-40)(33-36)(33-48)(34-54)(35-42)(35-53)(36-44)(37-59)(37-61)(38-47)(38-48)(39-41)(40-55)(41-56)(42-43)(43-57)(44-47)(45-46)(45-49)(46-59)(48-60)(49-60)(49-61)(50-62)(51-63)(52-64)(53-65)(54-55)(54-62)(55-63)(56-57)(56-64)(57-65)(58-68)(59-68)(60-66)(61-67)(62-69)(63-69)(64-69)(65-69)(68-69)

Measurements (3)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
DU-1450.37 10.1002/ejic.202100468 2021
HL600.370.21 10.1002/ejic.202100468 2021
MIA PaCa-20.49 10.1002/ejic.202100468 2021