| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2008 | 21 | Yes |
Popular Name: (1S)-1-(2,4-dimethoxyphenyl)-2-(4-ethylpiperazin-1-yl)ethanamine (1S)-1-(2,4-dimethoxyphenyl)-2-(…
| 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) | -0.23 | 4.23 | -103.15 | 4 | 5 | 2 | 54 | 295.427 | 6 | ↓ |
| Hi High (pH 8-9.5) | -0.23 | 1.92 | -46.17 | 3 | 5 | 1 | 53 | 294.419 | 6 | ↓ |
| Hi High (pH 8-9.5) | -0.23 | 1.67 | -4.29 | 2 | 5 | 0 | 51 | 293.411 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.23 | 3.59 | -34.18 | 3 | 5 | 1 | 52 | 294.419 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.23 | 3.83 | -133.11 | 4 | 5 | 2 | 54 | 295.427 | 6 | ↓ |
