| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 20 | Yes |
Popular Name: 1-(4-hydroxyphenyl)-2-[4-[(1S)-1-methylpropyl]piperazin-1-yl]ethanone 1-(4-hydroxyphenyl)-2-[4-[(1S)-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) | 2.11 | 4.91 | -36.41 | 2 | 4 | 1 | 45 | 277.388 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.11 | 3.78 | -42.36 | 0 | 4 | -1 | 47 | 275.372 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.11 | 3 | -7.85 | 1 | 4 | 0 | 44 | 276.38 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
