| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 21 | Yes |
Popular Name: 1,3-benzodioxol-5-yl-[4-(3-hydroxypropyl)piperazin-1-yl]methanone 1,3-benzodioxol-5-yl-[4-(3-hydro…
| 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) | 0.33 | 2.96 | -51.92 | 2 | 6 | 1 | 63 | 293.343 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.33 | 0.77 | -9.87 | 1 | 6 | 0 | 62 | 292.335 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
