Info
| ID | 3762 |
| Metal | Ru |
| Oxidation state | 3 |
| Charge | 0 |
| Donor atoms | {"N": 6} |
| Abbreviation | 2 |
| SMILES | CC(C)(C)c1cc(C(C)(C)C)n2ncnc2n1.CC(C)(C)c1cc(C(C)(C)C)n2ncnc2n1.CC(C)(C)c1cc(C(C)(C)C)n2ncnc2n1.[Cl-].[Cl-].[Cl-] |
TUCAN
C39H60N12Ru/(1-61)(2-61)(3-61)(4-62)(5-64)(6-94)(7-62)(8-64)(9-62)(10-64)(11-79)(12-63)(13-63)(14-63)(15-68)(16-68)(17-68)(18-73)(19-73)(20-73)(21-74)(22-65)(23-65)(24-80)(25-74)(26-95)(27-65)(28-66)(29-66)(30-74)(31-66)(32-75)(33-81)(34-75)(35-75)(36-67)(37-67)(38-67)(39-69)(40-69)(41-69)(42-70)(43-70)(44-70)(45-76)(46-76)(47-76)(48-77)(49-71)(50-71)(51-71)(52-72)(53-72)(54-77)(55-72)(56-77)(57-78)(58-78)(59-96)(60-78)(61-83)(62-82)(63-82)(64-83)(65-83)(66-84)(67-84)(68-82)(69-84)(70-86)(71-86)(72-86)(73-85)(74-85)(75-85)(76-87)(77-87)(78-87)(79-88)(79-89)(80-90)(80-91)(81-92)(81-93)(82-89)(83-88)(84-90)(85-91)(86-92)(87-93)(88-103)(89-100)(90-104)(91-101)(92-105)(93-102)(94-106)(94-109)(95-107)(95-110)(96-108)(96-111)(97-100)(97-103)(97-106)(98-101)(98-104)(98-107)(99-102)(99-105)(99-108)(103-109)(104-110)(105-111)(106-112)(107-112)(108-112)(109-112)(110-112)(111-112)
Measurements (2)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| T47D | 0.06 | — | 10.1039/c2dt32216a | 2013 |
| A549 | 1.1 | — | 10.1039/c2dt32216a | 2013 |
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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