| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 18 | Yes |
Popular Name: [(2S,6S)-2,6-dimethylpiperazin-1-yl]-(2-methoxy-3-pyridyl)methanone [(2S,6S)-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) | -0.03 | 2.88 | -57.39 | 2 | 5 | 1 | 59 | 250.322 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.03 | 1.55 | -12.09 | 1 | 5 | 0 | 54 | 249.314 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
