| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2011 | 17 | Yes |
Popular Name: 6-[[isobutyl(methyl)amino]methyl]-1,3-benzodioxol-5-ol 6-[[isobutyl(methyl)amino]methyl…
| 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) | 2.67 | 4.47 | -38.39 | 2 | 4 | 1 | 43 | 238.307 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.67 | 5.23 | -32.02 | 1 | 4 | 0 | 46 | 237.299 | 4 | ↓ |
