| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 19th, 2011 | 19 | Yes |
Popular Name: (1S,6R)-9-methyl-4-[(3-vinylphenyl)methyl]-4,9-diazabicyclo[4.2.1]nonane (1S,6R)-9-methyl-4-[(3-vinylphen…
| 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) | 3.11 | 9.4 | -33.39 | 1 | 2 | 1 | 8 | 257.401 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.11 | 9.49 | -31 | 1 | 2 | 1 | 8 | 257.401 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.11 | 10.84 | -107.8 | 2 | 2 | 2 | 9 | 258.409 | 3 | ↓ |
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)
![3-benzyl-3,9-diazabicyclo[4.2.1]nonane](http://zinc12.docking.org/img/rings/405681.gif)