| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 15 | Yes |
Popular Name: (3S)-3-[4-(2-hydroxyethyl)piperazin-1-yl]tetrahydrofuran-2-one (3S)-3-[4-(2-hydroxyethyl)pipera…
| 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) | -1.56 | -1.8 | -11.8 | 1 | 5 | 0 | 53 | 214.265 | 3 | ↓ |
| Mid Mid (pH 6-8) | -1.56 | 0.52 | -37.27 | 2 | 5 | 1 | 54 | 215.273 | 3 | ↓ |
| Mid Mid (pH 6-8) | -1.56 | 0.56 | -39.76 | 2 | 5 | 1 | 54 | 215.273 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
