| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2011 | 17 | No |
Popular Name: 2-[1-[(3R)-1,1-dioxothiolan-3-yl]-4-piperidyl]acetic 2-[1-[(3R)-1,1-dioxothiolan-3-yl…
| 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) | 0.33 | 4.34 | -73.43 | 1 | 5 | 0 | 79 | 261.343 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.33 | 2.17 | -53.03 | 0 | 5 | -1 | 78 | 260.335 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
