home← all complexes D-MPNN

Complex #3676 — Ru(2) [Ru2]

2D Structure

Structure
⬇ MOL V3000

Info

ID3676
MetalRu
Oxidation state2
Charge1
Donor atoms{"N": 6, "P": 1}
AbbreviationRu2
SMILESO=C1N[C@H]2CSC(CCCCC(=O)OCc3ccnc(-c4cc(COC(=O)CCCCC5SC[C@H]6NC(=O)N[C@@H]56)ccn4)c3)[C@H]2N1.c1cc[cH-]c1.c1ccc(P(c2ccccc2)c2ccccc2)cc1

TUCAN

C55H60N6O6PRuS2/(1-62)(2-61)(3-63)(4-64)(5-66)(6-67)(7-65)(8-112)(9-71)(10-68)(11-112)(12-72)(13-77)(14-69)(15-99)(16-70)(17-81)(18-75)(19-74)(20-114)(21-73)(22-82)(23-100)(24-76)(25-86)(26-87)(27-85)(28-88)(29-113)(30-113)(31-102)(32-87)(33-85)(34-115)(35-88)(36-86)(37-103)(38-103)(39-78)(40-79)(41-104)(42-95)(43-90)(44-89)(45-84)(46-83)(47-80)(48-92)(49-90)(50-92)(51-101)(52-91)(53-104)(54-91)(55-96)(56-89)(57-116)(58-117)(59-118)(60-119)(61-62)(61-68)(62-109)(63-68)(63-69)(64-65)(64-71)(65-72)(66-70)(66-77)(67-74)(67-77)(69-109)(70-110)(71-73)(72-73)(74-110)(75-76)(75-81)(76-111)(78-93)(78-97)(79-93)(79-95)(80-94)(80-96)(81-82)(82-83)(83-111)(84-94)(84-98)(85-87)(85-114)(86-88)(86-107)(87-88)(89-92)(89-115)(90-91)(90-108)(91-92)(93-103)(94-104)(95-120)(96-121)(97-98)(97-120)(98-121)(99-100)(99-114)(99-116)(100-112)(100-117)(101-102)(101-115)(101-118)(102-113)(102-119)(103-126)(104-127)(105-116)(105-117)(105-123)(106-118)(106-119)(106-124)(107-122)(107-126)(108-125)(108-127)(109-128)(110-128)(111-128)(112-129)(113-130)(114-129)(115-130)(120-131)(121-131)(126-131)(127-131)(128-131)(129-131)(130-131)

Measurements (2)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
MDA-MB-23112 10.1016/j.ejmech.2018.12.022 2019
MCF-732 10.1016/j.ejmech.2018.12.022 2019