Descriptions of ten reaction classes and the fraction of USPTO_50K and USPTO_MIT.
Reaction class | Reaction name | Fraction of USPTO_50k (%) | Fraction of USPTO_MIT (%) |
---|---|---|---|
1 | Heteroatom alkylation and arylation | 30.3 | 29.9 |
2 | Acylation and related processes | 23.8 | 24.9 |
3 | C–C bond formation | 11.3 | 13.4 |
4 | Heterocycle formation | 1.8 | 0.7 |
5 | Protections | 1.3 | 0.3 |
6 | Deprotections | 16.5 | 14.1 |
7 | Reductions | 9.2 | 9.4 |
8 | Oxidations | 1.6 | 2.0 |
9 | Functional group interconversion (FGI) | 3.7 | 5.0 |
10 | Functional group addition (FGA) | 0.5 | 0.2 |