| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 18 | Yes |
Popular Name: [(2S,6R)-2,6-dimethylpiperazin-1-yl]-(2,6-dimethyl-3-pyridyl)methanone [(2S,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) | 0.06 | 4.1 | -50.7 | 2 | 4 | 1 | 50 | 248.35 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.06 | 2.54 | -7.16 | 1 | 4 | 0 | 45 | 247.342 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
