| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 17 | Yes |
Popular Name: 5-[(2R,6R)-2,6-dimethylpiperazine-1-carbonyl]-1H-pyrazin-2-one 5-[(2R,6R)-2,6-dimethylpiperazin…
| 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) | -0.69 | 1.34 | -47.96 | 3 | 6 | 1 | 83 | 237.283 | 1 | ↓ |
| Hi High (pH 8-9.5) | -0.23 | -2.13 | -39.33 | 1 | 6 | -1 | 81 | 235.267 | 1 | ↓ |
| Mid Mid (pH 6-8) | -0.69 | -0.04 | -8.72 | 2 | 6 | 0 | 78 | 236.275 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
