| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2008 | 21 | Yes |
Popular Name: (1S)-2-(4-ethylpiperazin-1-yl)-1-(4-isopropoxyphenyl)ethanamine (1S)-2-(4-ethylpiperazin-1-yl)-1…
| 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) | 0.52 | 6.32 | -105.29 | 4 | 4 | 2 | 45 | 293.455 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.52 | 5.68 | -36.64 | 3 | 4 | 1 | 43 | 292.447 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.52 | 5.95 | -137.83 | 4 | 4 | 2 | 45 | 293.455 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.52 | 4.01 | -46.89 | 3 | 4 | 1 | 43 | 292.447 | 6 | ↓ |
