| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2011 | 26 | Yes |
Popular Name: 1-(2-bromobenzyl)azepane 1-(2-bromobenzyl)azepane
| 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) | 2.67 | 9.62 | -42.82 | 2 | 5 | 1 | 53 | 349.458 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.67 | 9.09 | -13.83 | 1 | 5 | 0 | 52 | 348.45 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.67 | 10.09 | -85.99 | 3 | 5 | 2 | 54 | 350.466 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
