| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 15th, 2011 | 15 | Yes |
Popular Name: (2S,6R)-2,6-dimethyl-1-[(1-methylimidazol-2-yl)methyl]piperazine (2S,6R)-2,6-dimethyl-1-[(1-methy…
| 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) | -0.14 | 2.71 | -86.03 | 3 | 4 | 2 | 39 | 210.325 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.14 | 2.06 | -6.07 | 1 | 4 | 0 | 33 | 208.309 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.14 | 1.37 | -27.92 | 2 | 4 | 1 | 34 | 209.317 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.14 | 3.41 | -42.91 | 2 | 4 | 1 | 38 | 209.317 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
