| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2011 | 21 | Yes |
Popular Name: 1-[2-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-2-oxo-ethyl]azepan-2-one 1-[2-(3,4-dihydro-2H-1,5-naphthy…
| 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) | 1.60 | 7.08 | -17.1 | 0 | 5 | 0 | 54 | 287.363 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.60 | 7.48 | -39.5 | 1 | 5 | 1 | 55 | 288.371 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1-[2-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-2-keto-ethyl]azepan-2-one](http://zinc12.docking.org/img/rings/378121.gif)