| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 24th, 2008 | 32 | Yes |
Popular Name: 2-(4-benzyl-1,4-diazepan-1-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-acetamide 2-(4-benzyl-1,4-diazepan-1-yl)-N…
| 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) | 4.94 | 11.13 | -48.72 | 2 | 6 | 1 | 55 | 436.576 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.94 | 13.08 | -127.51 | 3 | 6 | 2 | 56 | 437.584 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.94 | 10.67 | -51.35 | 2 | 6 | 1 | 55 | 436.576 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![Spiro[1,3-benzodioxole-2,1'-cyclohexane]](http://zinc12.docking.org/img/rings/10268.gif)
![2-(4-benzyl-1,4-diazepan-1-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-acetamide](http://zinc12.docking.org/img/rings/137626.gif)