| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 21 | Yes |
Popular Name: 1-(1,3-benzodioxol-5-yl)-2-[2-dimethylaminoethyl(propyl)amino]ethanone 1-(1,3-benzodioxol-5-yl)-2-[2-di…
| 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) | 2.29 | 6.49 | -39.84 | 1 | 5 | 1 | 43 | 293.387 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.29 | 3.99 | -10.75 | 0 | 5 | 0 | 42 | 292.379 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.29 | 6.03 | -45.66 | 1 | 5 | 1 | 43 | 293.387 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.29 | 8.49 | -129.21 | 2 | 5 | 2 | 44 | 294.395 | 8 | ↓ |
