| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 14th, 2009 | 29 | Yes |
Popular Name: (4aS,5S)-N-isobutyl-3-phenethyl-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinoline-5-carboxamide (4aS,5S)-N-isobutyl-3-phenethyl-…
| 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) | 4.31 | 12.63 | -48.59 | 2 | 4 | 1 | 37 | 392.567 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.31 | 10.42 | -10.85 | 1 | 4 | 0 | 36 | 391.559 | 6 | ↓ |
![2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline](http://zinc12.docking.org/img/rings/41406.gif)
![3-phenethyl-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinoline](http://zinc12.docking.org/img/rings/41911.gif)
