| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 5th, 2011 | 21 | Yes |
Popular Name: 2-(4-bromophenoxy)-1-[4-(2-hydroxyethyl)-1,4-diazepan-1-yl]ethanone 2-(4-bromophenoxy)-1-[4-(2-hydro…
| 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) | 1.68 | 6.49 | -43.32 | 2 | 5 | 1 | 54 | 358.256 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.68 | 4.58 | -12.55 | 1 | 5 | 0 | 53 | 357.248 | 5 | ↓ |
