| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 19th, 2010 | 18 | Yes |
Popular Name: (3R,8aS)-3-[(2-methoxyphenyl)methyl]-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine (3R,8aS)-3-[(2-methoxyphenyl)met…
| 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) | 2.18 | 4.98 | -35.39 | 2 | 3 | 1 | 29 | 247.362 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.18 | 6 | -29.8 | 2 | 3 | 1 | 26 | 247.362 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.18 | 3.74 | -3.72 | 1 | 3 | 0 | 24 | 246.354 | 3 | ↓ |
