| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2013 | 36 | No |
Popular Name: 4,4-Dimethyl-3,5,8-trioxabicyclo[5.1.0]octane 4,4-Dimethyl-3,5,8-trioxabicyclo…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 57280-22-5 , [57280-22-5]
None
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|
| Hi High (pH 8-9.5) | 1.85 | 7.41 | -103.36 | 6 | 8 | 2 | 116 | 496.562 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.