| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2008 | 20 | Yes |
Popular Name: N-(2-cyanoethyl)-N-phenyl-2-piperazin-1-yl-acetamide N-(2-cyanoethyl)-N-phenyl-2-pipe…
| 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) | 0.14 | 6.06 | -46.68 | 2 | 5 | 1 | 61 | 273.36 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.14 | 3.84 | -12.61 | 1 | 5 | 0 | 59 | 272.352 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.14 | 5.26 | -51.13 | 2 | 5 | 1 | 64 | 273.36 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.14 | 7.46 | -130.93 | 3 | 5 | 2 | 65 | 274.368 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
