heteroaromatic parent groupWithin: aromatic ring.
A compound has heteroaromatic ring when it has any of the groups below. A parent group is never matched itself, and its count of a compound is the number of occurrences of all of them together.
Parent groups under it: azine (6-ring), azole (5-ring), heteroaromatic lactam (pyridinone, pyrimidinone).
Through the parent groups above, also: pyridine, pyrimidine, pyridinone (2-/4-pyridone), pyrimidinone (uracil/cytosine type), pyrazine, pyridazine, 1,3,5-triazine, 1,2,3-/1,2,4-triazine, tetrazine, pyrrole, indole, imidazole, pyrazole, 1,2,3-triazole, 1,2,4-triazole, tetrazole, oxazole, isoxazole, thiazole, isothiazole, oxadiazole, thiadiazole.
The annotated compounds are those with experimental reference data plus small, neutral organic compounds (up to 12 heavy atoms), not every ATB molecule. Through the API: GET /api/v1/molecules?functional_group=heteroaromatic.
Annotation scheme 2.