| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2008 | 27 | Yes |
Popular Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(1,1-diethylprop-2-ynyl)acetamide 2-[4-(1,3-benzodioxol-5-ylmethyl…
| 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) | 3.10 | 6.97 | -45.7 | 2 | 6 | 1 | 55 | 372.489 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.11 | 4.77 | -14.31 | 1 | 6 | 0 | 54 | 371.481 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
