| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 14 | Yes |
Popular Name: (7S,8R,9R,9aR)-7,8,9-trihydroxy-1,2,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-3-one (7S,8R,9R,9aR)-7,8,9-trihydroxy-…
| 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) | -2.06 | -6.44 | -43.17 | 5 | 6 | 1 | 94 | 203.218 | 0 | ↓ |
| Mid Mid (pH 6-8) | -2.06 | -8.93 | -8.4 | 4 | 6 | 0 | 93 | 202.21 | 0 | ↓ |
