| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 17th, 2011 | 23 | Yes |
Popular Name: (1S,6R)-9-[(3-allyl-4-methoxy-phenyl)methyl]-3-methyl-3,9-diazabicyclo[4.2.1]nonan-4-one (1S,6R)-9-[(3-allyl-4-methoxy-ph…
| 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) | 3.63 | 9.63 | -49.18 | 1 | 4 | 1 | 34 | 315.437 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.63 | 7.52 | -9.04 | 0 | 4 | 0 | 33 | 314.429 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![4,9-diazabicyclo[4.2.1]nonan-3-one](http://zinc12.docking.org/img/rings/33368.gif)
![9-benzyl-4,9-diazabicyclo[4.2.1]nonan-3-one](http://zinc12.docking.org/img/rings/406642.gif)