| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2009 | 20 | Yes |
Popular Name: (2S)-1-(3,4-dimethoxyphenyl)-2-piperazin-1-yl-propan-1-one (2S)-1-(3,4-dimethoxyphenyl)-2-p…
| 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) | 0.76 | 3.47 | -49.02 | 2 | 5 | 1 | 55 | 279.36 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.76 | 2.05 | -10.72 | 1 | 5 | 0 | 51 | 278.352 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.76 | 4.22 | -38.88 | 2 | 5 | 1 | 52 | 279.36 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.76 | 5.62 | -123.73 | 3 | 5 | 2 | 57 | 280.368 | 5 | ↓ |
