Info
| ID | 39 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 5, "O": 1} |
| Abbreviation | 1c |
| SMILES | Cc1ccnc(-c2cc(C)ccn2)c1.Cc1ccnc(-c2cc(C)ccn2)c1.O=[N+]([O-])c1cccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)c1 |
TUCAN
C43H35N9O2Ru/(1-36)(2-66)(3-36)(4-64)(5-36)(6-37)(7-37)(8-48)(9-44)(10-45)(11-50)(12-52)(13-63)(14-65)(15-55)(16-53)(17-40)(18-43)(19-37)(20-41)(21-38)(22-67)(23-49)(24-47)(25-46)(26-38)(27-42)(28-68)(29-38)(30-39)(31-39)(32-51)(33-39)(34-54)(35-80)(36-57)(37-58)(38-59)(39-62)(40-42)(40-61)(41-49)(41-56)(42-47)(43-57)(43-63)(44-57)(44-69)(45-58)(45-70)(46-59)(46-65)(47-71)(48-50)(48-64)(49-66)(50-60)(51-58)(51-67)(52-59)(52-72)(53-61)(53-71)(54-62)(54-68)(55-62)(55-73)(56-74)(56-77)(60-75)(60-76)(61-78)(63-82)(64-83)(65-84)(66-79)(67-85)(68-87)(69-70)(69-82)(70-85)(71-81)(72-73)(72-84)(73-87)(74-76)(74-80)(75-77)(75-83)(76-86)(77-79)(78-80)(78-86)(81-88)(81-89)(82-90)(83-90)(84-90)(85-90)(86-90)(87-90)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| SW620 | 27 | — | 10.1021/ic100277w | 2010 |
| HepG2 | 35 | — | 10.1021/ic100277w | 2010 |
| A375 | 36 | — | 10.1021/ic100277w | 2010 |
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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