| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2008 | 24 | Yes |
Popular Name: (1S)-N-[(7-bromo-1,3-benzodioxol-5-yl)methyl]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanamine (1S)-N-[(7-bromo-1,3-benzodioxol…
| 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) | 3.59 | 7.43 | -56.45 | 2 | 5 | 1 | 54 | 393.257 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.59 | 6.15 | -8.77 | 1 | 5 | 0 | 49 | 392.249 | 4 | ↓ |
