| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2009 | 21 | Yes |
Popular Name: (1S)-N-[(5-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-1-(3-pyridyl)ethanamine (1S)-N-[(5-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) | 2.66 | 6.9 | -50.13 | 2 | 4 | 1 | 48 | 350.236 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.66 | 5.77 | -7.96 | 1 | 4 | 0 | 43 | 349.228 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
