| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 14th, 2011 | 17 | Yes |
Popular Name: (3S)-1-(1,3-benzodioxol-5-ylmethyl)-N-methyl-pyrrolidin-3-amine (3S)-1-(1,3-benzodioxol-5-ylmeth…
| 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) | 1.54 | 3.96 | -40.57 | 2 | 4 | 1 | 35 | 235.307 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.54 | 2.79 | -43.83 | 2 | 4 | 1 | 38 | 235.307 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.54 | 5.24 | -118.75 | 3 | 4 | 2 | 40 | 236.315 | 3 | ↓ |
