| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2010 | 20 | Yes |
Popular Name: 3-[4-(2-hydroxyethyl)piperazin-1-yl]-1-(p-tolyl)propan-1-one 3-[4-(2-hydroxyethyl)piperazin-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) | 1.47 | 4.48 | -43.09 | 2 | 4 | 1 | 45 | 277.388 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.47 | 4.59 | -38.64 | 2 | 4 | 1 | 45 | 277.388 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.47 | 2.23 | -9.07 | 1 | 4 | 0 | 44 | 276.38 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
