| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 21st, 2011 | 24 | Yes |
Popular Name: 1H-azepine-1-acetamide, N-[2-chloro-5-[(1-oxobutyl)amino]phenyl]hexahydro- 1H-azepine-1-acetamide, N-[2-chl…
| 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) | 4.15 | 8.42 | -45.04 | 3 | 5 | 1 | 63 | 352.886 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.97 | 7.52 | -32.6 | 2 | 5 | 0 | 69 | 351.878 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
