| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 21 | Yes |
Popular Name: (1S)-1-(4-ethoxyphenyl)-2-(4-isopropylpiperazin-1-yl)ethanamine (1S)-1-(4-ethoxyphenyl)-2-(4-iso…
| 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) | 0.45 | 6.14 | -102.35 | 4 | 4 | 2 | 45 | 293.455 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.45 | 3.92 | -43.78 | 3 | 4 | 1 | 43 | 292.447 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.45 | 3.5 | -3.41 | 2 | 4 | 0 | 42 | 291.439 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.45 | 5.33 | -38.7 | 3 | 4 | 1 | 43 | 292.447 | 6 | ↓ |
