| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 19th, 2010 | 12 | Yes |
Popular Name: (3S,8aS)-3-isopropyl-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine (3S,8aS)-3-isopropyl-1,2,3,4,6,7…
| 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) | 1.49 | 3.47 | -35.12 | 2 | 2 | 1 | 20 | 169.292 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.49 | 5.31 | -105.39 | 3 | 2 | 2 | 21 | 170.3 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.49 | 4.1 | -27.68 | 2 | 2 | 1 | 16 | 169.292 | 1 | ↓ |
