| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 31 | No |
Popular Name: ethyl ethyl
None
None
| 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) | 2.36 | 5.69 | -13.85 | 1 | 8 | 0 | 96 | 423.469 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.36 | 6.47 | -41.91 | 0 | 8 | -1 | 99 | 422.461 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.36 | 7.88 | -56.17 | 2 | 8 | 1 | 97 | 424.477 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.36 | 8.36 | -108.4 | 3 | 8 | 2 | 99 | 425.485 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
