| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 19th, 2010 | 17 | Yes |
Popular Name: (3S,8aS)-3-[(2-fluorophenyl)methyl]-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine (3S,8aS)-3-[(2-fluorophenyl)meth…
| 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) | 2.29 | 5.74 | -31.15 | 2 | 2 | 1 | 20 | 235.326 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.29 | 6.47 | -30.85 | 2 | 2 | 1 | 16 | 235.326 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.29 | 4.5 | -2.98 | 1 | 2 | 0 | 15 | 234.318 | 2 | ↓ |
