Info
| ID | 269 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 4, "O": 1, "P": 2} |
| Abbreviation | Complex 6 |
| SMILES | CN(C)C(=S)N=C([O-])c1ccco1.c1ccc(-c2ccccn2)nc1.c1ccc(P(CCCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1 |
TUCAN
C46H45N4O2P2RuS/(1-85)(2-47)(3-85)(4-49)(5-48)(6-51)(7-46)(8-54)(9-86)(10-86)(11-52)(12-63)(13-73)(14-67)(15-66)(16-70)(17-76)(18-78)(19-74)(20-74)(21-75)(22-50)(23-53)(24-75)(25-76)(26-76)(27-77)(28-77)(29-69)(30-71)(31-59)(32-55)(33-56)(34-68)(35-57)(36-58)(37-61)(38-60)(39-62)(40-65)(41-64)(42-77)(43-79)(44-82)(45-72)(46-47)(46-87)(47-49)(48-49)(48-50)(50-87)(51-53)(51-54)(52-54)(52-56)(53-88)(55-57)(55-59)(56-88)(57-89)(58-59)(58-60)(60-89)(61-62)(61-68)(62-90)(63-67)(63-80)(64-65)(64-90)(65-68)(66-67)(66-78)(69-71)(69-73)(70-72)(70-83)(71-79)(72-82)(73-81)(74-75)(74-85)(75-86)(76-92)(77-92)(78-93)(79-95)(80-81)(80-93)(81-95)(82-97)(83-84)(83-97)(84-94)(84-96)(85-98)(86-99)(87-98)(88-98)(89-99)(90-99)(91-92)(91-94)(91-100)(93-101)(94-101)(95-101)(97-101)(98-101)(99-101)
Measurements (5)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MDA-MB-231 | 0.11 | — | 10.1016/j.msec.2020.111106 | 2020 |
| DU-145 | 0.19 | — | 10.1016/j.msec.2020.111106 | 2020 |
| A549 | 0.25 | — | 10.1016/j.msec.2020.111106 | 2020 |
| MRC-5 | 0.77 | — | 10.1016/j.msec.2020.111106 | 2020 |
| MCF-10A | 0.77 | — | 10.1016/j.msec.2020.111106 | 2020 |
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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