| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 16 | No |
Popular Name: (3R,4S)-4-[(2S)-2-methylazepan-1-yl]-1,1-dioxo-thiolan-3-ol (3R,4S)-4-[(2S)-2-methylazepan-1…
| 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) | 0.69 | 1.48 | -44.5 | 2 | 4 | 1 | 59 | 248.368 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.69 | -0.61 | -10.84 | 1 | 4 | 0 | 58 | 247.36 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
