| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 20 | Yes |
Popular Name: [(9aS)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl]-[4-(aminomethyl)phenyl]methanone [(9aS)-1,3,4,6,7,8,9,9a-octahydr…
| 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) | 0.88 | 5.97 | -99.61 | 4 | 4 | 2 | 52 | 275.396 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.88 | 3.34 | -8.23 | 2 | 4 | 0 | 50 | 273.38 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.88 | 3.74 | -56.72 | 3 | 4 | 1 | 51 | 274.388 | 2 | ↓ |
