| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 31st, 2011 | 31 | Yes |
Popular Name: N-[[6-(4-methyl-1,4-diazepan-1-yl)-3-pyridyl]methyl]-4-phenoxy-benzamide N-[[6-(4-methyl-1,4-diazepan-1-y…
| 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) | 3.65 | 12.4 | -43.02 | 2 | 6 | 1 | 59 | 417.533 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.65 | 10.38 | -10.25 | 1 | 6 | 0 | 58 | 416.525 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.65 | 12.74 | -104.23 | 3 | 6 | 2 | 60 | 418.541 | 6 | ↓ |
