| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 29th, 2011 | 21 | No |
Popular Name: N-benzyl-2-[4-[(E)-3-chloroallyl]piperazin-1-yl]-N-methyl-ethanamine N-benzyl-2-[4-[(E)-3-chloroallyl…
| 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) | 2.45 | 7.32 | -38.06 | 1 | 3 | 1 | 11 | 308.877 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.45 | 4.99 | -3.09 | 0 | 3 | 0 | 10 | 307.869 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.45 | 9.6 | -95.08 | 2 | 3 | 2 | 12 | 309.885 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
