| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 18 | No |
Popular Name: (3R,4S)-4-[(3S)-3-(diethylamino)pyrrolidin-1-yl]-1,1-dioxo-thiolan-3-ol (3R,4S)-4-[(3S)-3-(diethylamino)…
| 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) | -0.15 | -0.18 | -47.86 | 2 | 5 | 1 | 62 | 277.41 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.15 | -2.62 | -11.02 | 1 | 5 | 0 | 61 | 276.402 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.15 | 1.97 | -120.62 | 3 | 5 | 2 | 63 | 278.418 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.15 | -0.5 | -44.11 | 2 | 5 | 1 | 62 | 277.41 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
