| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 21 | Yes |
Popular Name: (2S)-N-(1,3-benzodioxol-5-ylmethyl)-1-(4-bromophenyl)propan-2-amine (2S)-N-(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) | 4.33 | 7.69 | -5.79 | 1 | 3 | 0 | 30 | 348.24 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.33 | 8.89 | -47.8 | 2 | 3 | 1 | 35 | 349.248 | 5 | ↓ |
