| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2009 | 17 | Yes |
Popular Name: 3-[(3-bromo-4-hydroxy-5-methoxy-phenyl)methylamino]propanoic 3-[(3-bromo-4-hydroxy-5-methoxy-…
| 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) | 1.32 | 3.69 | -55.22 | 3 | 5 | 0 | 86 | 304.14 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.32 | 4.6 | -79.34 | 2 | 5 | -1 | 89 | 303.132 | 6 | ↓ |
