| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 25 | Yes |
Popular Name: 1-[(11bS)-1,3,4,6,7,11b-hexahydropyrazino[2,1-a]isoquinolin-2-yl]-3-phenoxy-propan-1-one 1-[(11bS)-1,3,4,6,7,11b-hexahydr…
| 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) | 3.08 | 8.46 | -9.85 | 0 | 4 | 0 | 33 | 336.435 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.08 | 10.6 | -46.59 | 1 | 4 | 1 | 34 | 337.443 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2,3,4,6,7,11b-hexahydro-1H-pyrazino[2,1-a]isoquinoline](http://zinc12.docking.org/img/rings/61495.gif)
![1-(1,3,4,6,7,11b-hexahydropyrazino[2,1-a]isoquinolin-2-yl)-3-phenoxy-propan-1-one](http://zinc12.docking.org/img/rings/61547.gif)