| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 18 | Yes |
Popular Name: (3S,5S)-3-[4-(2-ethoxyethyl)piperazin-1-yl]-5-methyl-tetrahydrofuran-2-one (3S,5S)-3-[4-(2-ethoxyethyl)pipe…
| 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) | -0.46 | 4.5 | -38.52 | 1 | 5 | 1 | 43 | 257.354 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.46 | 2.17 | -10.36 | 0 | 5 | 0 | 42 | 256.346 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
