| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 14th, 2011 | 23 | Yes |
Popular Name: 4-(benzylamino)-1-[(1S,6R)-9-methyl-4,9-diazabicyclo[4.2.1]nonan-4-yl]butan-1-one 4-(benzylamino)-1-[(1S,6R)-9-met…
| 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) | 1.93 | 10.42 | -94.21 | 3 | 4 | 2 | 41 | 317.477 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.93 | 9.08 | -42.53 | 2 | 4 | 1 | 37 | 316.469 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![4,9-diazabicyclo[4.2.1]nonane](http://zinc12.docking.org/img/rings/40550.gif)
![4-(benzylamino)-1-(4,9-diazabicyclo[4.2.1]nonan-4-yl)butan-1-one](http://zinc12.docking.org/img/rings/579247.gif)