| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2011 | 15 | Yes |
Popular Name: 1-[(2S,4R)-2-isopropyltetrahydropyran-4-yl]piperazine 1-[(2S,4R)-2-isopropyltetrahydro…
| 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) | 1.12 | 2.85 | -39.51 | 2 | 3 | 1 | 29 | 213.345 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.12 | 1.5 | -2.38 | 1 | 3 | 0 | 24 | 212.337 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
