Info
| ID | 517 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 8} |
| Abbreviation | Ru1 |
| SMILES | Clc1ccc(-c2ccc(-c3nc4c5cccnc5c5ncccc5c4[nH]3)cc2)cc1.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1 |
TUCAN
C73H47ClN8Ru/(1-48)(2-66)(3-49)(4-52)(5-67)(6-56)(7-106)(8-77)(9-50)(10-55)(11-57)(12-51)(13-107)(14-53)(15-78)(16-65)(17-62)(18-60)(19-72)(20-84)(21-73)(22-59)(23-58)(24-108)(25-109)(26-63)(27-64)(28-79)(29-69)(30-76)(31-80)(32-110)(33-105)(34-74)(35-81)(36-82)(37-54)(38-61)(39-71)(40-68)(41-83)(42-75)(43-86)(44-70)(45-85)(46-87)(47-122)(48-50)(48-52)(49-50)(49-56)(51-55)(51-57)(52-88)(53-55)(53-65)(54-71)(54-79)(56-88)(57-98)(58-62)(58-105)(59-60)(59-120)(60-103)(61-71)(61-80)(62-89)(63-90)(63-106)(64-92)(64-107)(65-98)(66-67)(66-91)(67-93)(68-75)(68-81)(69-94)(69-108)(70-74)(70-103)(72-73)(72-97)(73-102)(74-120)(75-83)(76-95)(76-109)(77-78)(77-96)(78-99)(79-100)(80-100)(81-101)(82-83)(82-101)(84-87)(84-97)(85-86)(85-104)(86-110)(87-102)(88-90)(89-116)(89-118)(90-91)(91-111)(92-93)(92-98)(93-112)(94-96)(94-100)(95-99)(95-101)(96-113)(97-119)(99-117)(102-103)(104-114)(104-115)(105-121)(106-123)(107-124)(108-127)(109-128)(110-125)(111-112)(111-123)(112-124)(113-117)(113-127)(114-118)(114-126)(115-116)(115-125)(116-121)(117-128)(118-122)(119-122)(119-126)(120-129)(123-130)(124-130)(125-130)(126-130)(127-130)(128-130)
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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