| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 19 | Yes |
Popular Name: (3R)-3-[[(1R)-4-hydroxyindan-1-yl]amino]azepan-2-one (3R)-3-[[(1R)-4-hydroxyindan-1-y…
| 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) | 1.88 | 2.55 | -42.45 | 4 | 4 | 1 | 66 | 261.345 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.88 | 2.61 | -8.39 | 3 | 4 | 0 | 61 | 260.337 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
