| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 16 | Yes |
Popular Name: (2S)-1-[(8aR)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-2-amino-pentan-1-one (2S)-1-[(8aR)-3,4,6,7,8,8a-hexah…
| 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) | 0.25 | 4.06 | -96.6 | 4 | 4 | 2 | 52 | 227.352 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.25 | 1.64 | -5.45 | 2 | 4 | 0 | 50 | 225.336 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.25 | 1.94 | -42.59 | 3 | 4 | 1 | 51 | 226.344 | 3 | ↓ |
