| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 22 | Yes |
Popular Name: (3S,5S)-3-[4-[(2R)-2-hydroxy-2-phenyl-ethyl]piperazin-1-yl]-5-methyl-tetrahydrofuran-2-one (3S,5S)-3-[4-[(2R)-2-hydroxy-2-p…
| 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) | -0.01 | 3.04 | -10.83 | 1 | 5 | 0 | 53 | 304.39 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.01 | 5.34 | -45.49 | 2 | 5 | 1 | 54 | 305.398 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
