| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 21 | Yes |
Popular Name: (1S)-1-(1,3-benzodioxol-5-yl)-N-(2-dimethylaminoethyl)-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) | 1.53 | 4.69 | -120.78 | 4 | 5 | 2 | 54 | 295.427 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.53 | 5.57 | -108.83 | 4 | 5 | 2 | 53 | 295.427 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.53 | 2.21 | -51.39 | 3 | 5 | 1 | 53 | 294.419 | 8 | ↓ |
