| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 25th, 2011 | 21 | Yes |
Popular Name: (S)-3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(1-propylimidazol-2-yl)methanol (S)-3,4-dihydro-2H-1,5-benzodiox…
| 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) | 1.68 | 5.94 | -35.49 | 2 | 5 | 1 | 58 | 289.355 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.68 | 5.39 | -9.76 | 1 | 5 | 0 | 57 | 288.347 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
