Info
| ID | 1042 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 1, "P": 2} |
| Abbreviation | 4 |
| SMILES | CC(C)N(C(C)C)P(=O)(c1ccccc1)c1ccccc1P(C1CCCCC1)C1CCCCC1.Cc1ccc(C(C)C)cc1.[Cl-] |
TUCAN
C40H59NOP2Ru/(1-80)(2-68)(3-80)(4-60)(5-67)(6-83)(7-83)(8-70)(9-60)(10-60)(11-82)(12-82)(13-84)(14-98)(15-81)(16-62)(17-84)(18-87)(19-87)(20-81)(21-92)(22-69)(23-62)(24-62)(25-71)(26-72)(27-88)(28-74)(29-75)(30-63)(31-63)(32-93)(33-63)(34-64)(35-64)(36-76)(37-77)(38-99)(39-78)(40-79)(41-94)(42-64)(43-65)(44-65)(45-65)(46-66)(47-66)(48-66)(49-88)(50-61)(51-86)(52-85)(53-61)(54-61)(55-86)(56-89)(57-85)(58-89)(59-73)(60-92)(61-90)(62-92)(63-93)(64-93)(65-94)(66-94)(67-68)(67-90)(68-91)(69-70)(69-91)(70-90)(71-72)(71-95)(72-73)(73-74)(74-96)(75-76)(75-97)(76-77)(77-78)(78-79)(79-97)(80-82)(80-83)(81-83)(81-84)(82-98)(84-98)(85-86)(85-89)(86-87)(87-99)(88-89)(88-99)(91-92)(93-100)(94-100)(95-96)(95-102)(96-103)(97-103)(98-102)(99-102)(100-103)(101-103)(102-104)(103-104)
Measurements (4)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HeLa | 3.4 | — | 10.1021/acs.organomet.8b00402 | 2018 |
| BEAS-2B | 4.9 | — | 10.1021/acs.organomet.8b00402 | 2018 |
| A549 | 5 | — | 10.1021/acs.organomet.8b00402 | 2018 |
| 16HBE | 5.3 | — | 10.1021/acs.organomet.8b00402 | 2018 |
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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