| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 3rd, 2011 | 30 | Yes |
Popular Name: 1-[2-(6-fluoro-4H-1,3-benzodioxin-8-yl)ethyl]-3-[4-(4-pyridylmethyl)phenyl]urea 1-[2-(6-fluoro-4H-1,3-benzodioxi…
| 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) | 3.80 | 8.51 | -16.48 | 2 | 6 | 0 | 72 | 407.445 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.80 | 8.96 | -44.92 | 3 | 6 | 1 | 74 | 408.453 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1-[2-(4H-1,3-benzodioxin-8-yl)ethyl]-3-[4-(4-pyridylmethyl)phenyl]urea](http://zinc12.docking.org/img/rings/142981.gif)