Info
| ID | 2660 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 7} |
| Abbreviation | Ru1 |
| SMILES | C[C@H](CCC(=O)Nc1cc2cccnc2c2ncccc12)C1CCC2C3C(C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O)CC1C[C@H]3O.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1 |
TUCAN
C56H63N7O4Ru/(1-91)(2-90)(3-67)(4-103)(5-66)(6-70)(7-68)(8-73)(9-69)(10-89)(11-65)(12-90)(13-98)(14-104)(15-97)(16-99)(17-86)(18-86)(19-71)(20-117)(21-105)(22-64)(23-64)(24-100)(25-80)(26-107)(27-84)(28-84)(29-87)(30-95)(31-76)(32-91)(33-106)(34-92)(35-64)(36-81)(37-92)(38-66)(39-116)(40-118)(41-88)(42-85)(43-66)(44-74)(45-72)(46-75)(47-78)(48-77)(49-83)(50-65)(51-85)(52-88)(53-108)(54-89)(55-96)(56-65)(57-82)(58-79)(59-87)(60-120)(61-129)(62-130)(63-128)(64-95)(65-101)(66-102)(67-68)(67-69)(68-109)(69-103)(70-71)(70-73)(71-104)(72-75)(72-105)(73-110)(74-75)(74-111)(76-81)(76-93)(77-94)(77-114)(78-79)(78-112)(79-82)(80-83)(80-107)(81-106)(82-108)(83-94)(84-87)(84-95)(85-96)(85-116)(86-98)(86-117)(87-119)(88-89)(88-118)(89-102)(90-98)(90-118)(91-92)(91-99)(92-100)(93-114)(93-115)(94-113)(95-100)(96-97)(96-102)(97-99)(97-117)(98-102)(99-101)(100-101)(101-116)(103-121)(104-122)(105-123)(106-126)(107-124)(108-125)(109-112)(109-121)(110-111)(110-122)(111-123)(112-125)(113-115)(113-124)(114-120)(115-126)(116-130)(117-128)(118-129)(119-120)(119-127)(121-131)(122-131)(123-131)(124-131)(125-131)(126-131)(130-131)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MDA-MB-231 | — | — | 10.1039/d4qi03021d | 2025 |
| 4T1 | — | — | 10.1039/d4qi03021d | 2025 |
| HLF | — | — | 10.1039/d4qi03021d | 2025 |
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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