| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 16 | No |
Popular Name: N-(cyanomethyl)-2-(4-ethylpiperazin-1-yl)-2-oxo-acetamide N-(cyanomethyl)-2-(4-ethylpipera…
| 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) | -1.18 | 0.02 | -8.02 | 1 | 6 | 0 | 76 | 224.264 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.99 | 0.06 | -40.59 | 0 | 6 | -1 | 83 | 223.256 | 3 | ↓ |
| Mid Mid (pH 6-8) | -1.18 | 2.24 | -43.13 | 2 | 6 | 1 | 78 | 225.272 | 3 | ↓ |
