| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 14th, 2011 | 19 | Yes |
Popular Name: (3S)-1-(1,3-benzodioxol-5-ylmethyl)-N-propyl-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) | 2.41 | 5.6 | -40.9 | 2 | 4 | 1 | 35 | 263.361 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.41 | 4.45 | -43.72 | 2 | 4 | 1 | 38 | 263.361 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.41 | 6.78 | -121.89 | 3 | 4 | 2 | 40 | 264.369 | 5 | ↓ |
