| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 20 | Yes |
Popular Name: 1-[2-(4-isopropyl-3-methyl-phenoxy)ethyl]-4-methyl-piperazine 1-[2-(4-isopropyl-3-methyl-pheno…
| 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) | 3.33 | 8.29 | -35.3 | 1 | 3 | 1 | 17 | 277.432 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.33 | 8.2 | -33.76 | 1 | 3 | 1 | 17 | 277.432 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.33 | 5.82 | -4.28 | 0 | 3 | 0 | 16 | 276.424 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
