| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 12th, 2010 | 20 | Yes |
Popular Name: (1R,5S)-7-isopropyl-N-[2-(2-thienyl)ethyl]-7-azabicyclo[3.3.1]nonan-9-amine (1R,5S)-7-isopropyl-N-[2-(2-thie…
| 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) | 4.00 | 10.25 | -218.93 | 3 | 2 | 0 | 21 | 294.508 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.00 | 10.04 | -41.3 | 2 | 2 | 1 | 20 | 293.5 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.00 | 9.19 | -80.26 | 2 | 2 | 0 | 16 | 293.5 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3-azabicyclo[3.3.1]nonane](http://zinc12.docking.org/img/rings/44440.gif)
![3-azabicyclo[3.3.1]nonan-9-yl-[2-(2-thienyl)ethyl]amine](http://zinc12.docking.org/img/rings/517491.gif)