| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 3rd, 2010 | 27 | 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) | 1.84 | 7.18 | -16.28 | 1 | 7 | 0 | 74 | 376.432 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.69 | 6.51 | -60.56 | 1 | 7 | -1 | 80 | 375.424 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.84 | 7.53 | -42.11 | 0 | 7 | -1 | 76 | 375.424 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.84 | 10.23 | -43.89 | 2 | 7 | 1 | 75 | 377.44 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.84 | 9.73 | -50.69 | 1 | 7 | 0 | 78 | 376.432 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
