| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 15 | Yes |
Popular Name: Azepan-1-yl(cyclopentyl)acetonitrile Azepan-1-yl(cyclopentyl)acetonit…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1119449-72-7 , [1119449-72-7]
| 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) | 3.31 | 6.51 | -5.35 | 0 | 2 | 0 | 27 | 206.333 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.31 | 8.39 | -40.89 | 1 | 2 | 1 | 28 | 207.341 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
