| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2011 | 25 | Yes |
Popular Name: 2-(diethylamino)-N-[3-[(2S)-4-methyl-2-phenyl-piperazin-1-yl]propyl]acetamide 2-(diethylamino)-N-[3-[(2S)-4-me…
| 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) | 2.48 | 8.78 | -83.04 | 3 | 5 | 2 | 41 | 348.535 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.48 | 4.31 | -8.78 | 1 | 5 | 0 | 39 | 346.519 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.48 | 6.39 | -36.6 | 2 | 5 | 1 | 40 | 347.527 | 9 | ↓ |
