| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 28th, 2005 | 10 | Yes |
Popular Name: 8-AZAHYPOXANTHINE 8-AZAHYPOXANTHINE
Find On: PubMed — Wikipedia — Google
CAS Numbers: 2683-90-1 , 53472-18-7 , 57364-77-9 , 744991-61-5 , [2683-90-1]
1h-1,2,3-triazolo[4,5-d]pyrimidin-7-ol
1H-[1,2,3]Triazolo[4,5-d]pyrimidin-7(4H)-one
3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
3H-[1,2,3]Triazolo[4,5-d]pyrimidin-7-ol
7H-1,2,3-Triazolo[4,5-d]pyrimidin-7-one, 1,4-dihydro- (9CI)
7H-1,2,3-Triazolo[4,5-d]pyrimidin-7-one, 2,3-dihydro- (9CI)
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | -0.42 | -2.55 | -35.66 | 1 | 6 | -1 | 90 | 136.094 | 0 | ↓ |
| Mid Mid (pH 6-8) | -0.42 | -2.57 | -40.65 | 1 | 6 | -1 | 90 | 136.094 | 0 | ↓ |
| Mid Mid (pH 6-8) | -0.87 | -0.44 | -15 | 2 | 6 | 0 | 87 | 137.102 | 0 | ↓ |
| Mid Mid (pH 6-8) | -0.42 | -2.57 | -105.98 | 0 | 6 | -2 | 89 | 135.086 | 0 | ↓ |
| Mid Mid (pH 6-8) | -0.87 | -0.44 | -17.26 | 2 | 6 | 0 | 87 | 137.102 | 0 | ↓ |
| Mid Mid (pH 6-8) | -0.42 | -2.55 | -41.2 | 1 | 6 | -1 | 90 | 136.094 | 0 | ↓ |
| Lo Low (pH 4.5-6) | -0.87 | -1.09 | -26.19 | 2 | 6 | 0 | 87 | 137.102 | 0 | ↓ |
No pre-computed analogs available. Try a structural similarity search.