| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2008 | 27 | No |
Popular Name: 2-(4-methylphenoxy)-1-[4-(5-nitro-2-pyridyl)-1,4-diazepan-1-yl]ethanone 2-(4-methylphenoxy)-1-[4-(5-nitr…
| 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) | 2.88 | 10.64 | -18.9 | 0 | 8 | 0 | 91 | 370.409 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2-phenoxy-1-[4-(2-pyridyl)-1,4-diazepan-1-yl]ethanone](http://zinc12.docking.org/img/rings/56305.gif)