| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 20 | No |
Popular Name: (E)-1-[(2R,6R)-2,6-dimethylpiperazin-1-yl]-3-(4-methoxyphenyl)prop-2-en-1-one (E)-1-[(2R,6R)-2,6-dimethylpiper…
| 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) | 2.03 | 6.2 | -49.78 | 2 | 4 | 1 | 46 | 275.372 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.03 | 4.84 | -8.31 | 1 | 4 | 0 | 42 | 274.364 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
