| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 18 | No |
Popular Name: (E)-1-[(2R,6R)-2,6-dimethylpiperazin-1-yl]-3-phenyl-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) | 1.97 | 6.88 | -48.84 | 2 | 3 | 1 | 37 | 245.346 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.97 | 5.53 | -7.44 | 1 | 3 | 0 | 32 | 244.338 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
