| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 22nd, 2009 | 34 | No |
Popular Name: N-[6-[4-[(4-nitrophenyl)methyl]-1,4-diazepan-1-yl]-3-pyridyl]-2-phenoxy-acetamide N-[6-[4-[(4-nitrophenyl)methyl]-…
| 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) | 3.69 | 14.1 | -62.37 | 2 | 9 | 1 | 105 | 462.53 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.69 | 12.23 | -18.05 | 1 | 9 | 0 | 104 | 461.522 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.69 | 14.42 | -122.28 | 3 | 9 | 2 | 106 | 463.538 | 8 | ↓ |
