| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 15 | Yes |
Popular Name: 3-[[(3S,5S)-3,5-dimethylpiperazin-1-yl]methyl]-4-methyl-1,2,5-oxadiazole 3-[[(3S,5S)-3,5-dimethylpiperazi…
| 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) | 0.97 | 1.89 | -44.38 | 2 | 5 | 1 | 59 | 211.289 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.97 | 0.7 | -8.34 | 1 | 5 | 0 | 54 | 210.281 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
