| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 23rd, 2006 | 9 | Yes |
Popular Name: 2-OXABICYCLO[2.2.2]OCTAN-3-ONE 2-OXABICYCLO[2.2.2]OCTAN-3-ONE
Find On: PubMed — Wikipedia — Google
CAS Number: 4350-84-9
| 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) | 1.34 | 0.81 | -8.55 | 0 | 2 | 0 | 26 | 126.155 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 123 / 11 | TCI |
| MP | 128 | TCI |
No pre-computed analogs available. Try a structural similarity search.