home← all complexes D-MPNN

Complex #644 — Ru(2) [4]

2D Structure

Structure
⬇ MOL V3000

Info

ID644
MetalRu
Oxidation state2
Charge1
Donor atoms{"S": 3, "N": 3, "P": 1, "O": 1}
Abbreviation4
SMILESC1CSCCSCCS1.C1N2CN3CN1CP(C2)C3.O=C(C=C([O-])/C=C/c1ccc(O)cc1)/C=C/c1ccc(O)cc1

TUCAN

C31H39N3O4PRuS3/(1-41)(2-47)(3-40)(4-50)(5-45)(6-42)(7-55)(8-55)(9-56)(10-56)(11-57)(12-57)(13-43)(14-44)(15-51)(16-65)(17-65)(18-66)(19-66)(20-67)(21-67)(22-68)(23-68)(24-46)(25-52)(26-62)(27-48)(28-62)(29-63)(30-49)(31-63)(32-69)(33-69)(34-64)(35-70)(36-70)(37-64)(38-76)(39-77)(40-41)(40-58)(41-53)(42-43)(42-53)(43-58)(44-46)(44-60)(45-47)(45-59)(46-54)(47-53)(48-51)(48-54)(49-52)(49-54)(50-59)(50-61)(51-60)(52-61)(55-71)(55-72)(56-71)(56-73)(57-72)(57-73)(58-76)(59-74)(60-77)(61-75)(62-71)(62-78)(63-72)(63-78)(64-73)(64-78)(65-70)(65-79)(66-67)(66-79)(67-80)(68-69)(68-80)(69-81)(70-81)(76-82)(77-82)(78-82)(79-82)(80-82)(81-82)

Measurements (3)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HCT-1161.7e+02— 10.1016/j.jinorgbio.2021.11138... 2021
MCF-72e+02— 10.1016/j.jinorgbio.2021.11138... 2021
A549—— 10.1016/j.jinorgbio.2021.11138... 2021