| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 15th, 2011 | 14 | Yes |
Popular Name: (3R)-3-[(2S,6S)-2,6-dimethylpiperazin-1-yl]tetrahydrofuran-2-one (3R)-3-[(2S,6S)-2,6-dimethylpipe…
| 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) | -0.87 | 1.76 | -43.04 | 2 | 4 | 1 | 46 | 199.274 | 1 | ↓ |
| Hi High (pH 8-9.5) | -0.87 | 0.62 | -7.29 | 1 | 4 | 0 | 42 | 198.266 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
