Info
| ID | 6725 |
| Metal | Rh |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 3} |
| Abbreviation | Complex 8 |
| SMILES | Cc1c(C)c(C)[c-](C)c1C.Clc1ccc(C2=NN(c3nc4ccccc4s3)C(c3ccccc3)C2)cc1.[Cl-] |
TUCAN
C32H31ClN3RhS/(1-45)(2-38)(3-37)(4-32)(5-32)(6-32)(7-33)(8-33)(9-48)(10-40)(11-46)(12-60)(13-50)(14-39)(15-42)(16-50)(17-41)(18-47)(19-49)(20-43)(21-44)(22-33)(23-34)(24-34)(25-34)(26-35)(27-35)(28-35)(29-36)(30-36)(31-36)(32-51)(33-52)(34-53)(35-54)(36-55)(37-38)(37-63)(38-57)(39-40)(39-56)(40-42)(41-44)(41-61)(42-47)(43-47)(43-56)(44-46)(45-46)(45-58)(48-49)(48-63)(49-57)(50-59)(50-60)(51-52)(51-53)(52-54)(53-55)(54-55)(56-60)(57-59)(58-61)(58-65)(59-66)(60-64)(61-67)(62-64)(62-65)(62-67)(63-68)(64-66)(65-69)(66-69)(67-69)
Measurements (2)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| DL | 53 | — | 10.1016/j.jinorgbio.2022.11205... | 2023 |
| PBMC | 3.4e+02 | — | 10.1016/j.jinorgbio.2022.11205... | 2023 |
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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