| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2008 | 27 | Yes |
Popular Name: 3-[(3R)-1-[2-(azepan-1-yl)acetyl]-3-piperidyl]-1-(4-methylpiperazin-1-yl)propan-1-one 3-[(3R)-1-[2-(azepan-1-yl)acetyl…
| 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) | 1.66 | 8.5 | -44.6 | 1 | 6 | 1 | 48 | 379.569 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.66 | 6.26 | -10.77 | 0 | 6 | 0 | 47 | 378.561 | 5 | ↓ |
