Info
| ID | 6959 |
| Metal | Rh |
| Oxidation state | 3 |
| Charge | 0 |
| Donor atoms | {"N": 5, "S": 1} |
| Abbreviation | 1 |
| SMILES | COC([N-]n1cnnc1[S-])c1ccccn1.Cc1c(C)c(C)[c-](C)c1C |
TUCAN
C19H24N5ORhS/(1-25)(2-25)(3-25)(4-26)(5-26)(6-26)(7-27)(8-27)(9-27)(10-28)(11-28)(12-28)(13-29)(14-31)(15-32)(16-40)(17-30)(18-42)(19-41)(20-41)(21-41)(22-29)(23-29)(24-38)(25-33)(26-34)(27-35)(28-36)(29-37)(30-31)(30-38)(31-32)(32-39)(33-34)(33-35)(34-36)(35-37)(36-37)(38-44)(39-42)(39-44)(40-46)(40-48)(41-49)(42-47)(42-49)(43-45)(43-46)(43-50)(45-48)(46-47)(47-51)(48-51)(49-51)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A2780 | — | — | 10.1016/j.ica.2019.119265 | 2019 |
| A2780cisR | — | — | 10.1016/j.ica.2019.119265 | 2019 |
| HEK293 | — | — | 10.1016/j.ica.2019.119265 | 2019 |
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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