Info
| ID | 518 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 8} |
| Abbreviation | Ru2 |
| SMILES | c1ccc(-c2ccc(-c3nc4c5cccnc5c5ncccc5c4[nH]3)cc2)cc1.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1 |
TUCAN
C73H48N8Ru/(1-53)(2-49)(3-50)(4-51)(5-65)(6-52)(7-107)(8-54)(9-56)(10-57)(11-80)(12-66)(13-64)(14-73)(15-70)(16-55)(17-76)(18-60)(19-109)(20-63)(21-59)(22-79)(23-85)(24-62)(25-74)(26-61)(27-69)(28-67)(29-82)(30-108)(31-110)(32-78)(33-77)(34-58)(35-87)(36-75)(37-81)(38-84)(39-83)(40-111)(41-68)(42-71)(43-72)(44-86)(45-89)(46-112)(47-88)(48-123)(49-51)(49-90)(50-54)(50-90)(51-52)(52-54)(53-99)(53-107)(55-56)(55-92)(56-64)(57-61)(57-64)(58-87)(58-89)(59-60)(59-106)(60-95)(61-92)(62-63)(62-106)(63-95)(65-69)(65-91)(66-67)(66-73)(67-93)(68-70)(68-93)(69-100)(70-73)(71-74)(71-94)(72-75)(72-94)(74-78)(75-78)(76-79)(76-98)(77-86)(77-96)(79-109)(80-101)(80-108)(81-103)(81-110)(82-83)(82-102)(83-105)(84-104)(84-111)(85-87)(85-97)(86-112)(88-89)(88-97)(90-99)(91-99)(91-113)(92-101)(93-103)(94-104)(95-97)(96-116)(96-120)(98-114)(98-119)(100-101)(100-115)(102-103)(102-117)(104-105)(105-118)(106-121)(107-125)(108-126)(109-124)(110-127)(111-128)(112-122)(113-115)(113-125)(114-120)(114-124)(115-126)(116-119)(116-123)(117-118)(117-127)(118-128)(119-129)(120-122)(121-123)(121-129)(124-130)(125-130)(126-130)(127-130)(128-130)(129-130)
Measurements (7)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A549 | — | — | 10.1016/j.ejmech.2023.115541 | 2023 |
| HepG2 | — | — | 10.1016/j.ejmech.2023.115541 | 2023 |
| SGC-7901 | — | — | 10.1016/j.ejmech.2023.115541 | 2023 |
| LO2 | — | — | 10.1016/j.ejmech.2023.115541 | 2023 |
| HeLa | — | — | 10.1016/j.ejmech.2023.115541 | 2023 |
| BEL-7402 | — | — | 10.1016/j.ejmech.2023.115541 | 2023 |
| B16 | — | — | 10.1016/j.ejmech.2023.115541 | 2023 |
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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