Info
| ID | 3096 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 6} |
| Abbreviation | Ru.2Nap |
| SMILES | O=C(NCCCCCN1C(=O)c2cccc3cccc(c23)C1=O)c1ccnc(-c2cc(C(=O)NCCCCCN3C(=O)c4cccc5cccc(c45)C3=O)ccn2)c1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1 |
TUCAN
C66H56N10O6Ru/(1-57)(2-101)(3-108)(4-86)(5-68)(6-102)(7-70)(8-107)(9-108)(10-71)(11-86)(12-69)(13-75)(14-104)(15-72)(16-65)(17-59)(18-58)(19-63)(20-85)(21-76)(22-106)(23-61)(24-88)(25-87)(26-110)(27-60)(28-74)(29-79)(30-88)(31-77)(32-87)(33-110)(34-103)(35-73)(36-64)(37-105)(38-62)(39-89)(40-80)(41-89)(42-85)(43-78)(44-82)(45-107)(46-90)(47-81)(48-83)(49-90)(50-109)(51-67)(52-66)(53-109)(54-84)(55-123)(56-124)(57-59)(57-111)(58-59)(58-101)(60-63)(60-102)(61-63)(61-112)(62-64)(62-104)(64-78)(65-91)(65-113)(66-67)(66-106)(67-82)(68-69)(68-93)(69-70)(70-92)(71-75)(71-92)(72-91)(72-103)(73-83)(73-94)(74-100)(74-114)(75-76)(76-96)(77-79)(77-84)(78-115)(79-98)(80-100)(80-105)(81-83)(81-99)(82-116)(84-94)(85-87)(85-107)(86-87)(86-108)(88-89)(88-110)(89-90)(90-109)(91-117)(92-95)(93-95)(93-118)(94-97)(95-96)(96-119)(97-98)(97-99)(98-121)(99-122)(100-120)(101-127)(102-128)(103-129)(104-131)(105-130)(106-132)(107-123)(108-125)(109-124)(110-126)(111-112)(111-127)(112-128)(113-114)(113-129)(114-130)(115-116)(115-131)(116-132)(117-123)(117-135)(118-125)(118-133)(119-125)(119-134)(120-124)(120-136)(121-126)(121-137)(122-126)(122-138)(127-139)(128-139)(129-139)(130-139)(131-139)(132-139)
Measurements (1)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HeLa | — | — | 10.1039/c5dt00360a | 2015 |
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.
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