| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2011 | 19 | Yes |
Popular Name: 1-(1,4-diazepan-1-yl)-2-(2,3-difluorophenoxy)ethanone 1-(1,4-diazepan-1-yl)-2-(2,3-dif…
| 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) | 1.14 | 6.41 | -57.81 | 2 | 4 | 1 | 46 | 271.287 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.14 | 5.03 | -18.95 | 1 | 4 | 0 | 42 | 270.279 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
