In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 20 | Yes |
Popular Name: 1-(1,3-benzodioxol-5-yl)-2-[(2S,5R)-2,5-dimethylmorpholin-4-yl]ethanone 1-(1,3-benzodioxol-5-yl)-2-[(2S,…
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) | 1.92 | 3.73 | -10.91 | 0 | 5 | 0 | 48 | 277.32 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.92 | 5.87 | -44.6 | 1 | 5 | 1 | 49 | 278.328 | 3 | ↓ |