| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2011 | 20 | Yes |
Popular Name: (S)-(2-amino-3-pyridyl)-(5-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methanol (S)-(2-amino-3-pyridyl)-(5-bromo…
| 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) | 1.84 | 3.4 | -37.29 | 4 | 5 | 1 | 79 | 338.181 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.84 | 2.92 | -9.69 | 3 | 5 | 0 | 78 | 337.173 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
