FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2894910016> ?p ?o ?g. }

• W2894910016 endingPage "2533" @default.
• W2894910016 startingPage "2533" @default.
• W2894910016 abstract "Rhombellanes represent a new class of structures, of which homeomorphs may be synthesized as real molecules. Cube-rhombellane is a double-shell structure, with vertices of degree 3 and 6, respectively. Several hypothetical structures/molecules were proposed and computed using molecular graph theory and coordination chemistry principles. Some geometries were optimized at the B3LYP/6-31G (d, p) level of theory, followed by harmonic vibrational frequency analysis at the same level of theory, single point data were collected in view of molecular stability evaluation. Some of the bioactive functionalized structures were also proposed and explored by molecular mechanics (MM)-based conformational analysis, to check their internal mobility. Drug-like properties of the proposed molecular structures were compared with some existing nano-molecules (fullerenes, nanotubes). ADME and other physico-chemical characteristics were computed using commercial software. Substructures of the proposed molecules, useful in a future synthesis, were provided by retro combinatorial synthesis (RECAP). Computational results obtained are promising regarding ADME properties, drug-likeness and nano-properties." @default.
• W2894910016 created "2018-10-12" @default.
• W2894910016 creator A5016829256 @default.
• W2894910016 creator A5030432650 @default.
• W2894910016 creator A5073892189 @default.
• W2894910016 date "2018-10-04" @default.
• W2894910016 modified "2023-10-05" @default.
• W2894910016 title "Cube-Rhombellane Related Structures: A Drug Perspective" @default.
• W2894910016 cites W1971775718 @default.
• W2894910016 cites W1983727079 @default.
• W2894910016 cites W1987111416 @default.
• W2894910016 cites W1989998618 @default.
• W2894910016 cites W1991286793 @default.
• W2894910016 cites W2023868310 @default.
• W2894910016 cites W2031563243 @default.
• W2894910016 cites W2046041874 @default.
• W2894910016 cites W2050564345 @default.
• W2894910016 cites W2056330498 @default.
• W2894910016 cites W2101183360 @default.
• W2894910016 cites W2105649494 @default.
• W2894910016 cites W2111163322 @default.
• W2894910016 cites W2114711900 @default.
• W2894910016 cites W2135732933 @default.
• W2894910016 cites W2141750360 @default.
• W2894910016 cites W2162415170 @default.
• W2894910016 cites W2165904924 @default.
• W2894910016 cites W2170378719 @default.
• W2894910016 cites W2330795913 @default.
• W2894910016 cites W2341929416 @default.
• W2894910016 cites W2342859247 @default.
• W2894910016 cites W2410498561 @default.
• W2894910016 cites W2471929598 @default.
• W2894910016 cites W2565825795 @default.
• W2894910016 cites W2729332695 @default.
• W2894910016 cites W2757001153 @default.
• W2894910016 cites W2800655597 @default.
• W2894910016 cites W2905591303 @default.
• W2894910016 cites W2949078105 @default.
• W2894910016 doi "https://doi.org/10.3390/molecules23102533" @default.
• W2894910016 hasPubMedCentralId "https://www.ncbi.nlm.nih.gov/pmc/articles/6222525" @default.
• W2894910016 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/30287782" @default.
• W2894910016 hasPublicationYear "2018" @default.
• W2894910016 type Work @default.
• W2894910016 sameAs 2894910016 @default.
• W2894910016 citedByCount "14" @default.
• W2894910016 countsByYear W28949100162019 @default.
• W2894910016 countsByYear W28949100162020 @default.
• W2894910016 countsByYear W28949100162021 @default.
• W2894910016 countsByYear W28949100162022 @default.
• W2894910016 countsByYear W28949100162023 @default.
• W2894910016 crossrefType "journal-article" @default.
• W2894910016 hasAuthorship W2894910016A5016829256 @default.
• W2894910016 hasAuthorship W2894910016A5030432650 @default.
• W2894910016 hasAuthorship W2894910016A5073892189 @default.
• W2894910016 hasBestOaLocation W28949100161 @default.
• W2894910016 hasConcept C114614502 @default.
• W2894910016 hasConcept C132525143 @default.
• W2894910016 hasConcept C147597530 @default.
• W2894910016 hasConcept C171250308 @default.
• W2894910016 hasConcept C178790620 @default.
• W2894910016 hasConcept C185592680 @default.
• W2894910016 hasConcept C192562407 @default.
• W2894910016 hasConcept C202751555 @default.
• W2894910016 hasConcept C2780022179 @default.
• W2894910016 hasConcept C32909587 @default.
• W2894910016 hasConcept C33923547 @default.
• W2894910016 hasConcept C41008148 @default.
• W2894910016 hasConcept C55493867 @default.
• W2894910016 hasConcept C69366308 @default.
• W2894910016 hasConcept C80444323 @default.
• W2894910016 hasConcept C88230418 @default.
• W2894910016 hasConceptScore W2894910016C114614502 @default.
• W2894910016 hasConceptScore W2894910016C132525143 @default.
• W2894910016 hasConceptScore W2894910016C147597530 @default.
• W2894910016 hasConceptScore W2894910016C171250308 @default.
• W2894910016 hasConceptScore W2894910016C178790620 @default.
• W2894910016 hasConceptScore W2894910016C185592680 @default.
• W2894910016 hasConceptScore W2894910016C192562407 @default.
• W2894910016 hasConceptScore W2894910016C202751555 @default.
• W2894910016 hasConceptScore W2894910016C2780022179 @default.
• W2894910016 hasConceptScore W2894910016C32909587 @default.
• W2894910016 hasConceptScore W2894910016C33923547 @default.
• W2894910016 hasConceptScore W2894910016C41008148 @default.
• W2894910016 hasConceptScore W2894910016C55493867 @default.
• W2894910016 hasConceptScore W2894910016C69366308 @default.
• W2894910016 hasConceptScore W2894910016C80444323 @default.
• W2894910016 hasConceptScore W2894910016C88230418 @default.
• W2894910016 hasIssue "10" @default.
• W2894910016 hasLocation W28949100161 @default.
• W2894910016 hasLocation W28949100162 @default.
• W2894910016 hasLocation W28949100163 @default.
• W2894910016 hasLocation W28949100164 @default.
• W2894910016 hasLocation W28949100165 @default.
• W2894910016 hasOpenAccess W2894910016 @default.
• W2894910016 hasPrimaryLocation W28949100161 @default.
• W2894910016 hasRelatedWork W1483890701 @default.
• W2894910016 hasRelatedWork W1670111303 @default.
• W2894910016 hasRelatedWork W2013842271 @default.

• next