| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 30th, 2008 | 25 | Yes |
Popular Name: 4-[1-[3-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]-4-piperidyl]-1,4-oxazepane 4-[1-[3-(5-methyl-1,3,4-thiadiaz…
| 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) | 2.78 | 7.62 | -41.65 | 1 | 5 | 1 | 43 | 359.519 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.78 | 5.58 | -9.94 | 0 | 5 | 0 | 41 | 358.511 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![4-[1-[3-(1,3,4-thiadiazol-2-yl)phenyl]-4-piperidyl]-1,4-oxazepane](http://zinc12.docking.org/img/rings/140380.gif)