| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 15th, 2011 | 16 | Yes |
Popular Name: [(2R,6R)-2,6-dimethylpiperazin-1-yl]-[(3R)-1-methylpyrrolidin-3-yl]methanone [(2R,6R)-2,6-dimethylpiperazin-1…
| 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) | 0.15 | 4.82 | -91.76 | 3 | 4 | 2 | 41 | 227.352 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.15 | 0.93 | -7.11 | 1 | 4 | 0 | 36 | 225.336 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.15 | 3.45 | -36.25 | 2 | 4 | 1 | 37 | 226.344 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
