| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 22 | Yes |
Popular Name: 1,3-benzodioxol-4-yl-[4-[(2R)-2-hydroxybutyl]piperazin-1-yl]methanone 1,3-benzodioxol-4-yl-[4-[(2R)-2-…
| 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) | 1.44 | 1.73 | -14.57 | 1 | 6 | 0 | 62 | 306.362 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.44 | 3.99 | -50.29 | 2 | 6 | 1 | 63 | 307.37 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
