| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 29th, 2009 | 21 | Yes |
Popular Name: 2-cyano-N-(2-oxo-2-piperazin-1-yl-ethyl)benzenesulfonamide 2-cyano-N-(2-oxo-2-piperazin-1-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) | -0.64 | -0.83 | -14.51 | 2 | 7 | 0 | 102 | 308.363 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.64 | -0.69 | -55.17 | 1 | 7 | -1 | 104 | 307.355 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.64 | 0.48 | -53.14 | 3 | 7 | 1 | 107 | 309.371 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
