Info
| ID | 312 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 6} |
| Abbreviation | 2 |
| SMILES | Cc1ccnc(-c2cc(C)ccn2)c1.Cc1ccnc(-c2cc(C)ccn2)c1.c1ccc(N(c2ccccc2)c2ccc(-c3nc4c5cccnc5c5ncccc5c4[nH]3)cc2)cc1 |
TUCAN
C55H45N9Ru/(1-46)(2-50)(3-57)(4-52)(5-46)(6-60)(7-53)(8-46)(9-47)(10-51)(11-64)(12-55)(13-67)(14-72)(15-47)(16-85)(17-47)(18-86)(19-56)(20-70)(21-63)(22-54)(23-74)(24-59)(25-61)(26-69)(27-58)(28-66)(29-65)(30-68)(31-84)(32-71)(33-83)(34-62)(35-48)(36-48)(37-48)(38-75)(39-73)(40-49)(41-87)(42-88)(43-49)(44-49)(45-102)(46-76)(47-77)(48-78)(49-79)(50-60)(50-89)(51-52)(51-64)(52-95)(53-76)(53-85)(54-77)(54-86)(55-76)(55-90)(56-59)(56-95)(57-65)(57-89)(58-61)(58-81)(59-64)(60-80)(61-84)(62-78)(62-87)(63-69)(63-96)(65-80)(66-71)(66-96)(67-70)(67-82)(68-69)(68-71)(70-83)(72-77)(72-93)(73-79)(73-88)(74-78)(74-98)(75-79)(75-99)(80-100)(81-92)(81-97)(82-91)(82-94)(83-101)(84-104)(85-105)(86-107)(87-108)(88-109)(89-103)(90-93)(90-105)(91-92)(91-101)(92-104)(93-107)(94-97)(94-102)(95-103)(96-103)(97-106)(98-99)(98-108)(99-109)(100-102)(100-106)(104-110)(105-110)(106-110)(107-110)(108-110)(109-110)
Measurements (4)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A549 | 13 | — | 10.1016/j.jinorgbio.2022.11196... | 2022 |
| B16 | 14 | — | 10.1016/j.jinorgbio.2022.11196... | 2022 |
| HepG2 | 19 | — | 10.1016/j.jinorgbio.2022.11196... | 2022 |
| LO2 | 58 | — | 10.1016/j.jinorgbio.2022.11196... | 2022 |
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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