| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2011 | 20 | No |
Popular Name: (E)-1-[(2S,5S)-2,5-dimethylpiperazin-1-yl]-3-(4-methoxyphenyl)prop-2-en-1-one (E)-1-[(2S,5S)-2,5-dimethylpiper…
| 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) | 2.38 | 6.29 | -48.05 | 2 | 4 | 1 | 46 | 275.372 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.38 | 5.14 | -9.09 | 1 | 4 | 0 | 42 | 274.364 | 3 | ↓ |
