| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2011 | 18 | Yes |
Popular Name: N-[(6-methyl-3-pyridyl)methyl]-2-piperazin-1-yl-acetamide N-[(6-methyl-3-pyridyl)methyl]-2…
| 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) | -0.54 | 1.17 | -43.43 | 3 | 5 | 1 | 62 | 249.338 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.54 | -0.2 | -8.96 | 2 | 5 | 0 | 57 | 248.33 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.54 | 1.6 | -81.68 | 4 | 5 | 2 | 63 | 250.346 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
