Sentence examples for categorization of compounds from inspiring English sources

Compound binning refers to the categorization of compounds into three groups: those which are highly stable and unlikely to present major challenges when it comes to drug stability (BIN 1), those which may be problematic with respect to chemical stability (BIN 2), or those which are chemically unstable and unlikely to have an adequate shelf-life (BIN 3).

Table 1 Criteria for categorization of compounds as POPs and LRT substances under the SC and UNECE Persistent (P) Bioaccumulative (B) Toxic (T) Potential for long-range transport (LRT) Water: DT501 > 2 months BCF or BAF >5,000 or Log KOW >5 No specific criteria other than 'significant adverse human health and/or environmental effects' (in Article 8, 7 (a)) Air: DT50 > 2 days.

This observation provides quantitative evidence supporting the categorization of compounds with high-quality curve classes as active.

Based on our results, we speculate that the inhibitory effects of phenolic compounds is a function of the combination of the occurrence of functional side groups (such as the methoxy and hydroxyl groups) and occurrence of unsaturated bonds in the structure of the compounds regardless of the categorization of the compounds as aldehydes, acid, alcohols or ketones.

The categorization of these compounds into CSSN types has potential application for mapping data sources especially if one of the sources is a UMLS source vocabulary.

We compared the results of a novel, empirical method to those based on categorization of PCB compounds by (1) hypothesized biological activity previously proposed and widely applied, and (2) degree of ortho- substitution (mono, di, tri), in a study of the relation of maternal serum PCBs and daughter's time to pregnancy.

It is used effectively to provide high-level categorizations for a random sample of compounds from the "Chemical Entities of Biological Interest" (ChEBI) ontology.

The main advantage of categorizing the compounds of ChEBI with CSSN types rather than with SN types is a more accurate categorization.

*3,5 Dichlorophenol was used as a positive control, **Minimal biocidal concentration [65] Table 3 Categorization of nanoparticles based on the toxicity values (EC50 or MBC, mg compound l−1) to bacteria, protozoa and algae.

Another intuitive categorization of activity cliffs has been introduced on the basis of consistently defined scaffolds (obtained from compounds by removal of R-groups) and the presence of different scaffold/R-group relationships, as illustrated in Figure 1C.

To classify the compounds into hepatotoxic and nonhepatotoxic groups, we initially followed the Drug-Induced Liver Injury Network's five-point categorization of the likelihood that a medication is associated with drug-induced liver injuries [24].