| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 21 | No |
Popular Name: (3S)-1-[[(3R)-1,1-dioxothian-3-yl]sulfamoyl]piperidine-3-carboxylic (3S)-1-[[(3R)-1,1-dioxothian-3-y…
| 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) | -0.71 | 0.02 | -60.98 | 1 | 8 | -1 | 124 | 339.415 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.71 | -0.39 | -107.6 | 0 | 8 | -2 | 126 | 338.407 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
