Info
| ID | 4639 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 6} |
| Abbreviation | Ru-3 |
| SMILES | Cc1ccnc(-c2cc(CO)ccn2)c1.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1 |
TUCAN
C60H44N6ORu/(1-46)(2-51)(3-48)(4-52)(5-54)(6-63)(7-53)(8-56)(9-66)(10-57)(11-62)(12-67)(13-65)(14-47)(15-69)(16-50)(17-70)(18-68)(19-92)(20-58)(21-76)(22-71)(23-104)(24-96)(25-60)(26-75)(27-97)(28-104)(29-72)(30-55)(31-64)(32-93)(33-59)(34-74)(35-94)(36-73)(37-95)(38-77)(39-49)(40-61)(41-45)(42-45)(43-45)(44-111)(45-78)(46-52)(46-54)(47-63)(47-66)(48-82)(48-92)(49-78)(49-97)(50-67)(50-69)(51-52)(51-79)(53-85)(53-93)(54-56)(55-86)(55-94)(56-79)(57-63)(57-83)(58-64)(58-80)(59-89)(59-95)(60-78)(60-102)(61-91)(61-96)(62-66)(62-83)(64-81)(65-67)(65-84)(68-70)(68-76)(69-71)(70-72)(71-84)(72-88)(73-76)(73-88)(74-77)(74-87)(75-91)(75-101)(77-90)(79-82)(80-82)(80-98)(81-85)(81-99)(83-85)(84-86)(86-87)(87-100)(88-89)(89-90)(90-103)(91-104)(92-105)(93-106)(94-107)(95-109)(96-108)(97-110)(98-99)(98-105)(99-106)(100-103)(100-107)(101-102)(101-108)(102-110)(103-109)(104-111)(105-112)(106-112)(107-112)(108-112)(109-112)(110-112)
Measurements (5)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HeLa | 5.2 | — | 10.1007/s00775-021-01901-8 | 2021 |
| A549 | 11 | — | 10.1007/s00775-021-01901-8 | 2021 |
| HepG2 | 14 | — | 10.1007/s00775-021-01901-8 | 2021 |
| LO2 | 17 | — | 10.1007/s00775-021-01901-8 | 2021 |
| A549cisR | 17 | — | 10.1007/s00775-021-01901-8 | 2021 |
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.
Loading source metadata…
The generated SVG will appear here. The legacy ligand image above stays visible for side-by-side review.