| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 25th, 2010 | 18 | No |
Popular Name: 2-[isobutyl-(2-oxo-2-piperazin-1-yl-ethyl)amino]acetamide 2-[isobutyl-(2-oxo-2-piperazin-1…
| 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) | -1.16 | 0.4 | -41.52 | 4 | 6 | 1 | 80 | 257.358 | 6 | ↓ |
| Hi High (pH 8-9.5) | -1.16 | -1.66 | -8.19 | 3 | 6 | 0 | 79 | 256.35 | 6 | ↓ |
| Mid Mid (pH 6-8) | -1.16 | 1.54 | -109.22 | 5 | 6 | 2 | 84 | 258.366 | 6 | ↓ |
