| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2011 | 22 | Yes |
Popular Name: 2-[4-[3-(2-chlorophenyl)propanoyl]-1,4-diazepan-1-yl]acetamide 2-[4-[3-(2-chlorophenyl)propanoy…
| 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) | 1.51 | 6.58 | -42.16 | 3 | 5 | 1 | 68 | 324.832 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.51 | 4.95 | -12.14 | 2 | 5 | 0 | 67 | 323.824 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
