| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 7th, 2011 | 24 | Yes |
Popular Name: 1-[4-[2-(azocan-1-yl)-2-oxo-ethyl]-1,4-diazepan-1-yl]-2,2-dimethyl-propan-1-one 1-[4-[2-(azocan-1-yl)-2-oxo-ethy…
| 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) | 2.80 | 9.95 | -44.51 | 1 | 5 | 1 | 45 | 338.516 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.80 | 8.19 | -14.73 | 0 | 5 | 0 | 44 | 337.508 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
