| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 30 | 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) | 2.65 | 9.38 | -53.73 | 2 | 7 | 1 | 94 | 409.462 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.65 | 7.69 | -42.3 | 0 | 7 | -1 | 96 | 407.446 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.65 | 7.11 | -13.24 | 1 | 7 | 0 | 93 | 408.454 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.65 | 9.96 | -35.35 | 1 | 7 | 0 | 97 | 408.454 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.65 | 9.86 | -90.91 | 3 | 7 | 2 | 95 | 410.47 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
