| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 10th, 2011 | 28 | Yes |
Popular Name: 1-[3-(1-naphthyl)-6,7-dihydro-4H-isoxazolo[4,5-c]pyridin-5-yl]-2-piperazin-1-yl-ethanone 1-[3-(1-naphthyl)-6,7-dihydro-4H…
| 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) | 1.91 | 7.52 | -53.8 | 2 | 6 | 1 | 66 | 377.468 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.91 | 6.14 | -17.99 | 1 | 6 | 0 | 62 | 376.46 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![4,5,6,7-tetrahydroisoxazolo[4,5-c]pyridine](http://zinc12.docking.org/img/rings/46500.gif)
![1-[3-(1-naphthyl)-6,7-dihydro-4H-isoxazolo[4,5-c]pyridin-5-yl]-2-piperazino-ethanone](http://zinc12.docking.org/img/rings/534189.gif)