| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 17th, 2008 | 21 | Yes |
Popular Name: (1R)-1-(1,3-benzodioxol-5-yl)-2-(4-propylpiperazin-1-yl)ethanamine (1R)-1-(1,3-benzodioxol-5-yl)-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) | 0.12 | 4.82 | -112.68 | 4 | 5 | 2 | 54 | 293.411 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.12 | 2.51 | -52.17 | 3 | 5 | 1 | 53 | 292.403 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.12 | 1.69 | -5.93 | 2 | 5 | 0 | 51 | 291.395 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.12 | 4.08 | -39.56 | 3 | 5 | 1 | 52 | 292.403 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.12 | 4.46 | -145.36 | 4 | 5 | 2 | 54 | 293.411 | 5 | ↓ |
