| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2011 | 18 | Yes |
Popular Name: (6R,7R)-6-amino-1-(2-methoxyethyl)-7-(3-thienyl)azepan-2-one (6R,7R)-6-amino-1-(2-methoxyethy…
| 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) | 0.59 | 3.64 | -55.01 | 3 | 4 | 1 | 57 | 269.39 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.59 | 3.4 | -5.73 | 2 | 4 | 0 | 56 | 268.382 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
