Info
| ID | 634 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 5} |
| Abbreviation | Ru-TPE-PPh3 |
| SMILES | Cc1ccc(C(C)C)cc1.Cc1ccnc(-c2cc(Cn3cc(-c4ccc(/C(=C(\c5ccccc5)c5ccc(-c6ccc(OCCCC[P+](c7ccccc7)(c7ccccc7)c7ccccc7)cc6)cc5)c5ccccc5)cc4)nn3)ccn2)c1.[Br-].[Cl-] |
TUCAN
C78H71N5OPRu/(1-122)(2-140)(3-78)(4-76)(5-118)(6-72)(7-72)(8-121)(9-77)(10-79)(11-87)(12-86)(13-89)(14-107)(15-94)(16-84)(17-80)(18-99)(19-85)(20-92)(21-139)(22-75)(23-105)(24-103)(25-106)(26-146)(27-111)(28-75)(29-121)(30-146)(31-137)(32-104)(33-98)(34-138)(35-100)(36-144)(37-122)(38-95)(39-96)(40-90)(41-144)(42-114)(43-88)(44-115)(45-116)(46-93)(47-109)(48-120)(49-102)(50-113)(51-110)(52-75)(53-140)(54-97)(55-117)(56-108)(57-112)(58-91)(59-119)(60-73)(61-72)(62-73)(63-73)(64-136)(65-81)(66-83)(67-101)(68-74)(69-74)(70-82)(71-74)(72-123)(73-136)(74-136)(75-129)(76-78)(76-84)(77-87)(77-128)(78-147)(79-84)(79-86)(80-88)(80-126)(81-83)(81-123)(82-101)(82-123)(83-127)(85-100)(85-145)(86-147)(87-134)(88-90)(89-92)(89-99)(90-91)(91-93)(92-94)(93-126)(94-103)(95-98)(95-132)(96-129)(96-142)(97-133)(97-138)(98-131)(99-148)(100-130)(101-127)(102-104)(102-119)(103-148)(104-107)(105-106)(105-111)(106-110)(107-135)(108-117)(108-134)(109-116)(109-132)(110-149)(111-112)(112-149)(113-129)(113-137)(114-115)(114-145)(115-130)(116-131)(117-128)(118-133)(118-141)(119-120)(120-135)(121-122)(121-146)(122-144)(124-125)(124-132)(124-135)(125-126)(125-128)(127-136)(130-131)(133-140)(134-143)(137-153)(138-150)(139-143)(139-151)(140-151)(141-142)(141-150)(142-153)(143-154)(144-155)(145-155)(146-156)(147-156)(148-156)(149-156)(151-152)(152-154)(153-157)(154-157)(155-157)(156-157)
Measurements (6)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A549 | 2.4 | — | 10.1016/j.jinorgbio.2024.11257... | 2024 |
| MCF-10A | 3 | — | 10.1016/j.jinorgbio.2024.11257... | 2024 |
| MCF-7 | 3.5 | — | 10.1016/j.jinorgbio.2024.11257... | 2024 |
| HLF | 3.8 | — | 10.1016/j.jinorgbio.2024.11257... | 2024 |
| MDA-MB-231 | 4 | — | 10.1016/j.jinorgbio.2024.11257... | 2024 |
| A549cisR | 4.9 | — | 10.1016/j.jinorgbio.2024.11257... | 2024 |
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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