| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 18 | Yes |
Popular Name: (1S)-1-(1,3-benzodioxol-5-yl)-N'-ethyl-N'-isopropyl-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) | 0.40 | 4.87 | -38.24 | 3 | 4 | 1 | 49 | 251.35 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.40 | 5.01 | -132.87 | 4 | 4 | 2 | 51 | 252.358 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.40 | 2.95 | -48.57 | 3 | 4 | 1 | 49 | 251.35 | 5 | ↓ |
