| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 22 | No |
Popular Name: 7-(azepan-1-ylmethyl)-6-hydroxy-2-isopropylidene-benzofuran-3-one 7-(azepan-1-ylmethyl)-6-hydroxy-…
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| 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) | 3.57 | 7.65 | -38.06 | 2 | 4 | 1 | 55 | 302.394 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.57 | 8.56 | -26.71 | 1 | 4 | 0 | 58 | 301.386 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
