| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 21 | No |
Popular Name: 2-[2-[(2S,6S)-2,6-dimethylpiperazin-1-yl]ethyl]isoindoline-1,3-dione 2-[2-[(2S,6S)-2,6-dimethylpipera…
| 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) | 1.51 | 4.25 | -43.25 | 2 | 5 | 1 | 59 | 288.371 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.51 | 3.08 | -8.47 | 1 | 5 | 0 | 54 | 287.363 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
