| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 20 | No |
Popular Name: 2-[[(2S,6S)-2,6-dimethylpiperazin-1-yl]methyl]isoindoline-1,3-dione 2-[[(2S,6S)-2,6-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) | 1.50 | 3.84 | -42.81 | 2 | 5 | 1 | 59 | 274.344 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.50 | 2.69 | -8.5 | 1 | 5 | 0 | 54 | 273.336 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
