| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 25th, 2011 | 21 | Yes |
Popular Name: (S)-(6-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-(1-ethylimidazol-2-yl)methanol (S)-(6-bromo-3,4-dihydro-2H-1,5-…
| 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) | 2.11 | 5.84 | -36.99 | 2 | 5 | 1 | 58 | 354.224 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.11 | 5.3 | -10.14 | 1 | 5 | 0 | 57 | 353.216 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
