| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 19 | Yes |
Popular Name: (1S)-1-(1,3-benzodioxol-5-yl)-N-isopropyl-N-propyl-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) | 2.17 | 5.1 | -128.03 | 4 | 4 | 2 | 51 | 266.385 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.17 | 3.94 | -49.77 | 3 | 4 | 1 | 49 | 265.377 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.17 | 4.73 | -33.6 | 3 | 4 | 1 | 49 | 265.377 | 6 | ↓ |
