| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 26th, 2009 | 19 | No |
Popular Name: (3R,4S)-4-[3-[(2S)-2-methyl-1-piperidyl]propylamino]-1,1-dioxo-thiolan-3-ol (3R,4S)-4-[3-[(2S)-2-methyl-1-pi…
| 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) | 0.24 | 0.59 | -42.49 | 3 | 5 | 1 | 71 | 291.437 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.24 | -0.32 | -53.93 | 3 | 5 | 1 | 74 | 291.437 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.24 | 1.79 | -120.84 | 4 | 5 | 2 | 75 | 292.445 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
