Info
| ID | 4085 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 2, "P": 2} |
| Abbreviation | 5 |
| SMILES | CCCCCCCCCCCC[N+]12CN3CN(CP(C3)C1)C2.[Cl-].c1cc[cH-]c1.c1ccc(P(c2ccccc2)c2ccccc2)cc1 |
TUCAN
C41H57N3P2Ru/(1-90)(2-63)(3-60)(4-61)(5-59)(6-62)(7-73)(8-65)(9-64)(10-66)(11-67)(12-72)(13-58)(14-58)(15-80)(16-80)(17-79)(18-79)(19-85)(20-85)(21-82)(22-82)(23-84)(24-84)(25-83)(26-83)(27-81)(28-81)(29-88)(30-88)(31-87)(32-87)(33-86)(34-86)(35-92)(36-92)(37-89)(38-89)(39-97)(40-97)(41-98)(42-98)(43-96)(44-96)(45-90)(46-91)(47-91)(48-68)(49-77)(50-74)(51-75)(52-69)(53-70)(54-78)(55-71)(56-76)(57-58)(58-80)(59-60)(59-63)(60-93)(61-62)(61-93)(62-63)(64-65)(64-73)(65-94)(66-67)(66-94)(67-73)(68-69)(68-70)(69-71)(70-76)(71-76)(72-77)(72-95)(74-78)(74-95)(75-77)(75-78)(79-80)(79-85)(81-83)(81-88)(82-84)(82-85)(83-84)(86-87)(86-89)(87-88)(89-101)(90-99)(90-101)(91-100)(91-101)(92-99)(92-100)(93-102)(94-102)(95-102)(96-101)(96-103)(97-99)(97-103)(98-100)(98-103)(102-104)(103-104)
Measurements (2)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| SK-OV-3 | 9.1 | — | 10.1016/j.ica.2012.04.031 | 2012 |
| SW480 | 9.7 | — | 10.1016/j.ica.2012.04.031 | 2012 |
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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