| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 21 | Yes |
Popular Name: (1S)-1-(1,3-benzodioxol-5-yl)-N'-isobutyl-N'-isopropyl-N-methyl-ethane-1,2-diamine (1S)-1-(1,3-benzodioxol-5-yl)-N'…
| 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) | 3.40 | 8.27 | -124.31 | 3 | 4 | 2 | 40 | 294.439 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.40 | 7.04 | -42.16 | 2 | 4 | 1 | 38 | 293.431 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.40 | 6.89 | -37.89 | 2 | 4 | 1 | 35 | 293.431 | 7 | ↓ |
