| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2011 | 18 | No |
Popular Name: (3S)-1-[(3R)-1,1-dioxothiolan-3-yl]-3-ethyl-piperidine-3-carboxylic (3S)-1-[(3R)-1,1-dioxothiolan-3-…
| 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) | 0.46 | 4.64 | -66.74 | 1 | 5 | 0 | 79 | 275.37 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.46 | 2.58 | -50.81 | 0 | 5 | -1 | 78 | 274.362 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
