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Complex #2484 — Ru(2) [1]

2D Structure

Structure
⬇ MOL V3000

Info

ID2484
MetalRu
Oxidation state2
Charge6
Donor atoms{"N": 8}
Abbreviation1
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.c1cnc2c(c1)c1nc3c4cccc5ccc6cccc(c3nc1c1cccnc12)c6c54

TUCAN

C76H94N12Ru/(1-95)(2-110)(3-95)(4-95)(5-96)(6-113)(7-146)(8-146)(9-114)(10-96)(11-111)(12-147)(13-147)(14-149)(15-107)(16-124)(17-96)(18-149)(19-150)(20-150)(21-152)(22-97)(23-97)(24-97)(25-145)(26-98)(27-98)(28-112)(29-98)(30-152)(31-153)(32-116)(33-99)(34-99)(35-99)(36-115)(37-100)(38-100)(39-145)(40-153)(41-117)(42-100)(43-109)(44-108)(45-148)(46-101)(47-154)(48-101)(49-139)(50-140)(51-101)(52-102)(53-102)(54-154)(55-102)(56-103)(57-103)(58-125)(59-155)(60-144)(61-142)(62-126)(63-141)(64-148)(65-155)(66-103)(67-104)(68-151)(69-104)(70-104)(71-105)(72-156)(73-120)(74-143)(75-118)(76-151)(77-156)(78-119)(79-105)(80-158)(81-158)(82-159)(83-157)(84-121)(85-105)(86-159)(87-106)(88-106)(89-160)(90-106)(91-122)(92-123)(93-157)(94-160)(95-146)(96-147)(97-149)(98-150)(99-152)(100-153)(101-154)(102-155)(103-156)(104-158)(105-159)(106-160)(107-108)(107-132)(108-109)(109-128)(110-111)(110-128)(111-131)(112-113)(112-129)(113-164)(114-115)(114-165)(115-130)(116-117)(116-131)(117-118)(118-133)(119-126)(119-134)(120-121)(120-135)(121-168)(122-123)(122-169)(123-136)(124-125)(124-138)(125-142)(126-144)(127-128)(127-132)(127-137)(129-139)(129-145)(130-140)(130-148)(131-137)(132-166)(133-137)(133-167)(134-163)(134-170)(135-141)(135-151)(136-143)(136-157)(138-161)(138-162)(139-178)(140-179)(141-180)(142-172)(143-181)(144-182)(145-173)(146-173)(147-173)(148-174)(149-173)(150-174)(151-175)(152-174)(153-174)(154-175)(155-175)(156-175)(157-176)(158-176)(159-176)(160-176)(161-163)(161-171)(162-170)(162-172)(163-177)(164-165)(164-178)(165-179)(166-167)(166-171)(167-177)(168-169)(168-180)(169-181)(170-182)(177-183)(178-183)(179-183)(180-183)(181-183)(182-183)

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
MCF-72.9e+02— 10.1021/ic900902f 2009
HepG23.4e+02— 10.1021/ic900902f 2009
BEL-74023.8e+02— 10.1021/ic900902f 2009
HeLa4.9e+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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