| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2011 | 21 | Yes |
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) | 1.71 | 6.41 | -39.38 | 2 | 5 | 1 | 46 | 298.451 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.71 | 4 | -4.53 | 1 | 5 | 0 | 45 | 297.443 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.71 | 7.73 | -89.17 | 3 | 5 | 2 | 51 | 299.459 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.71 | 5.58 | -36.77 | 2 | 5 | 1 | 46 | 298.451 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.71 | 7.98 | -110.87 | 3 | 5 | 2 | 47 | 299.459 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
