Info
| ID | 6177 |
| Metal | Re |
| Oxidation state | 1 |
| Charge | 1 |
| Donor atoms | {"O": 3, "N": 3} |
| Abbreviation | Re-py |
| SMILES | [C-]#[O+].[C-]#[O+].[C-]#[O+].c1ccncc1.c1cnc2c(c1)ccc1cccnc12 |
TUCAN
C20H13N3O3Re/(1-25)(2-27)(3-16)(4-18)(5-19)(6-21)(7-20)(8-14)(9-26)(10-28)(11-22)(12-17)(13-15)(14-17)(14-23)(15-21)(15-22)(16-19)(16-25)(17-24)(18-20)(18-27)(19-23)(20-24)(21-26)(22-28)(23-29)(24-30)(25-34)(26-35)(27-36)(28-35)(29-30)(29-34)(30-36)(31-37)(32-38)(33-39)(34-40)(35-40)(36-40)
Measurements (12)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A2780 | 20 | — | 10.1002/anie.202004883 | 2020 |
| HeLa | 33 | — | 10.1016/j.jinorgbio.2024.11260... | 2024 |
| HeLa | 39 | — | 10.1002/ejic.202100364 | 2021 |
| HeLa | 51 | — | 10.1016/j.jorganchem.2019.1210... | 2019 |
| A2780TR | 1.6e+02 | — | 10.1002/anie.202004883 | 2020 |
| PNT2 | — | — | 10.1016/j.jinorgbio.2024.11260... | 2024 |
| B16-F10 | — | — | 10.1016/j.jinorgbio.2024.11260... | 2024 |
| NIH-3T3 | — | — | 10.1016/j.jinorgbio.2024.11260... | 2024 |
| A549 | — | — | 10.1021/acsami.7b01764 | 2017 |
| A549cisR | — | — | 10.1021/acsami.7b01764 | 2017 |
| HeLa | — | — | 10.1021/acsami.7b01764 | 2017 |
| LO2 | — | — | 10.1021/acsami.7b01764 | 2017 |
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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