| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 17 | Yes |
Popular Name: 3-[(3,5-dibromo-4-ethoxy-phenyl)methylamino]propanenitrile 3-[(3,5-dibromo-4-ethoxy-phenyl)…
| 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) | 2.86 | 6.09 | -8.77 | 1 | 3 | 0 | 45 | 362.065 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.86 | 7.45 | -63.56 | 2 | 3 | 1 | 50 | 363.073 | 6 | ↓ |
