| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 18th, 2008 | 29 | No |
Popular Name: ethyl ethyl
| 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) | 3.81 | 11.68 | -50.73 | 0 | 6 | -1 | 85 | 395.431 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.81 | 12.49 | -11.02 | 1 | 6 | 0 | 82 | 396.439 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.23 | 11.73 | -15.91 | 0 | 6 | 0 | 79 | 396.439 | 11 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| mp | 207 - 208 | MolMall (formerly Molecular Diversity Preservation International) |
No pre-computed analogs available. Try a structural similarity search.
