Info
| ID | 557 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 8} |
| Abbreviation | Ru4 |
| SMILES | Cc1ccc2ccc3ccc(C)nc3c2n1.Cc1ccc2ccc3ccc(C)nc3c2n1.FC(F)(F)c1ccc(-c2ccc(-c3nc4c5cccnc5c5ncccc5c4[nH]3)cc2)cc1 |
TUCAN
C54H39F3N8Ru/(1-40)(2-49)(3-51)(4-40)(5-52)(6-47)(7-55)(8-40)(9-48)(10-50)(11-58)(12-56)(13-65)(14-64)(15-79)(16-63)(17-57)(18-41)(19-41)(20-66)(21-61)(22-44)(23-54)(24-46)(25-41)(26-42)(27-53)(28-60)(29-59)(30-78)(31-45)(32-42)(33-62)(34-42)(35-43)(36-43)(37-67)(38-43)(39-95)(40-83)(41-85)(42-88)(43-90)(44-46)(44-77)(45-62)(45-68)(46-72)(47-54)(47-76)(48-50)(48-83)(49-51)(49-69)(50-69)(51-70)(52-63)(52-71)(53-60)(53-72)(54-73)(55-57)(55-74)(56-58)(56-70)(57-75)(58-85)(59-61)(59-73)(60-77)(61-76)(62-78)(63-79)(64-65)(64-74)(65-88)(66-67)(66-75)(67-90)(68-84)(68-86)(69-80)(70-82)(71-81)(71-87)(72-73)(74-89)(75-91)(76-93)(77-92)(78-98)(79-94)(80-82)(80-96)(81-84)(81-95)(82-99)(83-96)(84-97)(85-99)(86-87)(86-98)(87-94)(88-100)(89-91)(89-100)(90-101)(91-101)(92-95)(92-97)(93-102)(93-103)(93-104)(96-105)(97-105)(98-105)(99-105)(100-105)(101-105)
Measurements (6)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| B16 | 33 | — | 10.1016/j.jinorgbio.2023.11223... | 2023 |
| HepG2 | 34 | — | 10.1016/j.jinorgbio.2023.11223... | 2023 |
| A549 | 47 | — | 10.1016/j.jinorgbio.2023.11223... | 2023 |
| HeLa | 63 | — | 10.1016/j.jinorgbio.2023.11223... | 2023 |
| BEL-7402 | — | — | 10.1016/j.jinorgbio.2023.11223... | 2023 |
| LO2 | — | — | 10.1016/j.jinorgbio.2023.11223... | 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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