In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 19 | No |
Popular Name: 6-[(3-methylsulfonylpropylamino)methyl]-1,3-benzodioxol-5-ol 6-[(3-methylsulfonylpropylamino)…
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) | 0.97 | -0.39 | -62.27 | 3 | 6 | 1 | 89 | 288.345 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.97 | 0.27 | -49.34 | 2 | 6 | 0 | 92 | 287.337 | 6 | ↓ |