| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 2nd, 2011 | 24 | Yes |
Popular Name: (11bR)-N-cyclopentyl-4-oxo-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinoline-2-sulfonamide (11bR)-N-cyclopentyl-4-oxo-3,6,7…
| 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) | 1.66 | 4.51 | -15.26 | 1 | 6 | 0 | 70 | 349.456 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.66 | 4.33 | -45.56 | 0 | 6 | -1 | 72 | 348.448 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1,2,3,6,7,11b-hexahydropyrazino[2,1-a]isoquinolin-4-one](http://zinc12.docking.org/img/rings/437.gif)
![N-cyclopentyl-4-keto-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinoline-2-sulfonamide](http://zinc12.docking.org/img/rings/119230.gif)