| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2009 | 20 | Yes |
Popular Name: (1S)-1-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-N-methyl-1-(4-pyridyl)methanamine (1S)-1-(6-bromo-2,3-dihydro-1,4-…
| 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) | 2.23 | 5.86 | -45.47 | 2 | 4 | 1 | 48 | 336.209 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.23 | 4.96 | -6.25 | 1 | 4 | 0 | 43 | 335.201 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.23 | 5.42 | -35.35 | 2 | 4 | 1 | 45 | 336.209 | 3 | ↓ |
