| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2011 | 20 | Yes |
Popular Name: 2-(azepan-1-yl)-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-acetamide 2-(azepan-1-yl)-N-[(5-ethyl-1,3,…
| 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) | 0.12 | 3.23 | -43.01 | 1 | 6 | 1 | 64 | 281.38 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.12 | 1.33 | -14.59 | 0 | 6 | 0 | 62 | 280.372 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
