| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2010 | 19 | No |
Popular Name: 4-[2-(4-isopropylphenyl)-2-oxo-ethyl]piperazin-2-one 4-[2-(4-isopropylphenyl)-2-oxo-e…
| 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) | 2.47 | 4.03 | -14.88 | 1 | 4 | 0 | 49 | 260.337 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.47 | 6.23 | -53.77 | 2 | 4 | 1 | 51 | 261.345 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
