| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2011 | 21 | Yes |
Popular Name: (6R,7R)-6-amino-1-isobutyl-7-(1,3,5-trimethylpyrazol-4-yl)azepan-2-one (6R,7R)-6-amino-1-isobutyl-7-(1,…
| 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) | 0.96 | 4.23 | -67.63 | 3 | 5 | 0 | 66 | 293.435 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.96 | 5.91 | -10.25 | 2 | 5 | 0 | 64 | 292.427 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
