| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 18 | No |
Popular Name: (2S,5R)-N-[(3R)-1,1-dioxothiolan-3-yl]-N,5-dimethyl-piperazine-2-carboxamide (2S,5R)-N-[(3R)-1,1-dioxothiolan…
| 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) | -1.07 | -1.95 | -54.94 | 3 | 6 | 1 | 83 | 276.382 | 2 | ↓ |
| Mid Mid (pH 6-8) | -1.07 | -3.11 | -16.86 | 2 | 6 | 0 | 79 | 275.374 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
