| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2010 | 30 | Yes |
Popular Name: Lupulone Lupulone
B'' -Acid;b-Bitter acid;b-Lupulic acid;b-Lupulinic acid;beta-Bitter acid;beta-Lupulic acid;Lupulon
None
| 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) | 5.16 | 15.32 | -13.17 | 0 | 4 | 0 | 68 | 414.586 | 9 | ↓ |
| Hi High (pH 8-9.5) | 5.74 | 13.28 | -7.55 | 0 | 4 | 0 | 74 | 413.578 | 9 | ↓ |
| Hi High (pH 8-9.5) | 6.32 | 14.02 | -108 | 0 | 4 | -2 | 80 | 412.57 | 8 | ↓ |
| Hi High (pH 8-9.5) | 5.74 | 13.38 | -6.79 | 0 | 4 | 0 | 74 | 413.578 | 9 | ↓ |
| Hi High (pH 8-9.5) | 5.74 | 13.83 | -45.62 | 0 | 4 | -1 | 74 | 413.578 | 8 | ↓ |
