| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 21 | Yes |
Popular Name: 1-(2,4-dichlorophenyl)-2-[4-[(1R)-1-methylpropyl]piperazin-1-yl]ethanone 1-(2,4-dichlorophenyl)-2-[4-[(1R…
| 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) | 3.87 | 8.75 | -37.07 | 1 | 3 | 1 | 25 | 330.279 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.87 | 6.8 | -7.21 | 0 | 3 | 0 | 24 | 329.271 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
