home← all complexes D-MPNN

Complex #3913 — Ru(2) [2e]

2D Structure

Structure
⬇ MOL V3000

Info

ID3913
MetalRu
Oxidation state2
Charge1
Donor atoms{"N": 2}
Abbreviation2e
SMILESCc1ccc(C(C)C)cc1.Clc1ccc(Cl)c(/N=C/c2ccccn2)c1.[I-]

TUCAN

C22H22Cl2N2Ru/(1-31)(2-30)(3-23)(4-35)(5-24)(6-23)(7-23)(8-39)(9-40)(10-34)(11-33)(12-27)(13-28)(14-29)(15-26)(16-24)(17-24)(18-25)(19-38)(20-32)(21-25)(22-25)(23-36)(24-38)(25-38)(26-28)(26-34)(27-29)(27-43)(28-39)(29-44)(30-31)(30-36)(31-37)(32-35)(32-37)(33-42)(33-44)(34-41)(35-36)(37-38)(39-46)(40-41)(40-45)(41-46)(42-43)(42-45)(43-47)(44-48)(45-49)(46-49)

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
MCF-757 10.1002/zaac.201600427 2017
Caco-21.1e+02 10.1002/zaac.201600427 2017
HepG21.4e+02 10.1002/zaac.201600427 2017
HEK2931.8e+02 10.1002/zaac.201600427 2017