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Complex #2485 — Ru(2) [2]

2D Structure

Structure
⬇ MOL V3000

Info

ID2485
MetalRu
Oxidation state2
Charge6
Donor atoms{"N": 8}
Abbreviation2
SMILESCC[N+](CC)(CC)Cc1ccc(-c2ccc(C[N+](CC)(CC)CC)cn2)nc1.CC[N+](CC)(CC)Cc1ccc(-c2ccc(C[N+](CC)(CC)CC)cn2)nc1.c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1

TUCAN

C66H90N12Ru/(1-131)(2-112)(3-131)(4-132)(5-91)(6-132)(7-133)(8-111)(9-134)(10-134)(11-106)(12-91)(13-91)(14-92)(15-92)(16-129)(17-104)(18-135)(19-92)(20-135)(21-136)(22-136)(23-137)(24-93)(25-93)(26-93)(27-94)(28-133)(29-137)(30-94)(31-138)(32-138)(33-126)(34-107)(35-127)(36-94)(37-139)(38-95)(39-109)(40-110)(41-95)(42-140)(43-108)(44-95)(45-96)(46-139)(47-96)(48-105)(49-125)(50-96)(51-128)(52-130)(53-97)(54-97)(55-141)(56-140)(57-113)(58-141)(59-97)(60-144)(61-144)(62-98)(63-98)(64-98)(65-99)(66-99)(67-145)(68-99)(69-116)(70-118)(71-100)(72-100)(73-142)(74-145)(75-103)(76-146)(77-100)(78-101)(79-101)(80-142)(81-101)(82-102)(83-114)(84-143)(85-117)(86-102)(87-146)(88-143)(89-102)(90-115)(91-131)(92-132)(93-134)(94-135)(95-136)(96-137)(97-138)(98-139)(99-141)(100-144)(101-145)(102-146)(103-104)(103-124)(104-129)(105-112)(105-125)(106-107)(106-148)(107-108)(108-118)(109-111)(109-149)(110-113)(110-150)(111-119)(112-120)(113-123)(114-116)(114-151)(115-117)(115-152)(116-121)(117-122)(118-155)(119-126)(119-133)(120-147)(120-154)(121-127)(121-140)(122-128)(122-142)(123-130)(123-143)(124-153)(124-156)(125-168)(126-164)(127-165)(128-166)(129-157)(130-167)(131-159)(132-159)(133-159)(134-159)(135-160)(136-160)(137-160)(138-161)(139-161)(140-160)(141-161)(142-161)(143-162)(144-162)(145-162)(146-162)(147-153)(147-163)(148-155)(148-163)(149-150)(149-164)(150-167)(151-152)(151-165)(152-166)(153-158)(154-156)(154-168)(155-158)(156-157)(163-169)(164-169)(165-169)(166-169)(167-169)(168-169)

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HeLa1.8e+02— 10.1021/ic900902f 2009
HepG23.7e+02— 10.1021/ic900902f 2009
BEL-74023.8e+02— 10.1021/ic900902f 2009
MCF-74.4e+02— 10.1021/ic900902f 2009

Source-assisted 2D generator

Builds the drawing from source ligand graphs and explicit donor metadata, then uses Metal2D only for layout. Publication output uses black bonds without arrows or colour highlighting; validated octahedral enantiomers are encoded directly with solid and hashed wedge bonds.

experimental validation surface
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