Info
| ID | 2171 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 4, "P": 2} |
| Abbreviation | 2 |
| SMILES | Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1.[Cl-].c1ccc(-c2ccccn2)nc1.c1ccc(P(CCCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1 |
TUCAN
C60H53ClN4P2Ru/(1-54)(2-56)(3-57)(4-94)(5-55)(6-107)(7-83)(8-99)(9-107)(10-102)(11-84)(12-58)(13-94)(14-108)(15-59)(16-60)(17-100)(18-86)(19-88)(20-67)(21-108)(22-95)(23-68)(24-66)(25-95)(26-81)(27-61)(28-62)(29-91)(30-65)(31-70)(32-69)(33-73)(34-77)(35-74)(36-76)(37-78)(38-79)(39-63)(40-80)(41-82)(42-75)(43-64)(44-87)(45-106)(46-101)(47-89)(48-93)(49-71)(50-72)(51-92)(52-85)(53-90)(54-56)(54-57)(55-57)(55-58)(56-109)(58-109)(59-60)(59-67)(60-68)(61-62)(61-72)(62-96)(63-65)(63-103)(64-82)(64-104)(65-83)(66-70)(66-74)(67-110)(68-69)(69-110)(70-73)(71-72)(71-87)(73-111)(74-77)(75-76)(75-79)(76-78)(77-111)(78-112)(79-80)(80-112)(81-91)(81-97)(82-84)(83-99)(84-102)(85-89)(85-92)(86-88)(86-91)(87-96)(88-113)(89-98)(90-92)(90-93)(93-98)(94-95)(94-107)(95-108)(96-105)(97-105)(97-113)(98-105)(99-116)(100-101)(100-114)(101-115)(102-117)(103-104)(103-116)(104-117)(105-114)(106-114)(106-115)(107-118)(108-119)(109-118)(110-118)(111-119)(112-119)(113-120)(115-121)(116-121)(117-121)(118-121)(119-121)
Measurements (4)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A549 | 0.47 | — | 10.1016/j.jinorgbio.2016.06.02... | 2016 |
| L-929 | 0.48 | — | 10.1016/j.jinorgbio.2016.06.02... | 2016 |
| MCF-7 | 1.7 | — | 10.1016/j.jinorgbio.2016.06.02... | 2016 |
| DU-145 | 3.3 | — | 10.1016/j.jinorgbio.2016.06.02... | 2016 |
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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